C50h58n7o9p Adenesinese, N-Benzoyl-5 '-o- [2-methylethyl)-2' -

sehlahisoa

C50h58n7o9p Adenesinese, N-Benzoyl-5 '-o- [2-methylethyl)-2' -

Tlhahisoleseling ea mantlha:


Lintlha tsa sehlahisoa

Li-tag tsa lihlahisoa

Lintlha tsa ntho

Nomoro ea ho re ngolisa

251647-7

H302

Thepa ea bohlokoa ea 'mele Boleng Boemo
Boima ba Molecular 932.01 -
pka (e boletsoeng esale pele) 7.87 ± 0.43 Boholo ba tempele ea acidic: 25 ° C

Mabitso a mang le khethollo

Cannonical smiles

N # CCCOP (OC1C (OC (N2C = NC = NC3) CC = CC5) N (C.) C) C) C) c

Isomerica e bososela

C (OC [OC @@ H] 1 [C @@ h] (OP (C = CC = C (OC) C = C5) (C6 = CC = C6) C7 = CC = cc

Inchi

Inchi = 1S / C50h584) 57 (35-63-5,3-6) 24-20) 24 9-21-25-41 (61-7) 26-22-39) 65-48-5) 55-48-1-76,153) 1-26, 32-32 42,424 4-45,48-31h, 14,28

Senotlolo sa Inchi

Vpbyqbqblyrlhg-hdmawcrfsa-n

Mabitso a mang a 16 bakeng sa ntho ena

Edenesinene,N-Benzoyl-5 '-O- [Bis (4-Meydoxl) PhenylMEthyl] -2 '-O- (2-Methoyethyl) -, 3 '- - - --yeothyl bis (1-methylethyl)

phosphoramite] (9ci); 4: Pn: PN: US20030211106 Leqephe la 19 4: PN: PN: US20030212011111111113 1 17: Pn: US20040005569 Page: 22 19: Pn: US20040006060033: 23 e tummeng; 19: PN: US20040014047

Leqephe: 21 tse tummeng; 19: Pn: US200400149 Leqephe: 21 Tse tummeng 20: PN: US200400055570 Page: 20 e reretsoeng

tatellano; 20: Pn: PN: US200400148 Leqephe: 21 Tse tummeng; 20: Pn: US20040014050 Leqephe: 21: Pn: U

S200400055565 LEQEPHE LA 17- 22 Tsebo ea Bokooa; 21 Pn: US200400140000000000 22: Pn: PN: US200400146996996996996 la 20. 23 Pn: PN: US200400060600299 Leqephe la 23 le bolailoe; 23: PN: Leqephe la Wo03106645 Leqephe: 73 e tummeng ka tatellano; 94: P N: US20040005707 Leqephe la 20 tse fetileng

Tekanyetso ea pono ea liteko

Spectra e fumanehang
1 h nmr
13 c nmr
Hetero nmr

Lipapatso tse boletsoeng esale pele

Thepa e fumanehang
Sa tlhaho
Lik'hemik'hale
LIPINSSKI
Sebopeho se amanang le

Sa tlhaho

Thepa Boleng Boemo Mohloli
Linkho tsa BioCentration 2680 ph 1; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 71500 ph 2; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 7.21 x 105 ph 3; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 1.00 x 106 PH 4; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 1.00 x 106 ph 5; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 1.00 x 106 PH 6; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 1.00 x 106 PH 7; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 8.48 x 105 PH 8; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 1.39 x 105 ph 9; TEMP: 25 ° C (1) ACD
Linkho tsa BioCentration 40300 ph 10; TEMP: 25 ° C (1) ACD

.

Lik'hemik'hale

Thepa Boleng Boemo Mohloli
Koc 1360 ph 1; TEMP: 25 ° C (1) ACD
Koc 36300 ph 2; TEMP: 25 ° C (1) ACD
Koc 3.66 x 105 ph 3; TEMP: 25 ° C (1) ACD
Koc 1.13 x 106 PH 4; TEMP: 25 ° C (1) ACD

 

Thepa Boleng Boemo Mohloli
Koc 1.42 x 106 ph 5; TEMP: 25 ° C (1) ACD
Koc 1.42 x 106 PH 6; TEMP: 25 ° C (1) ACD
Koc 1.17 x 106 PH 7; TEMP: 25 ° C (1) ACD
Koc 4.30 x 105 PH 8; TEMP: 25 ° C (1) ACD
Koc 70800 ph 9; TEMP: 25 ° C (1) ACD
Koc 20500 ph 10; TEMP: 25 ° C (1) ACD
logd 5.77 ph 1; TEMP: 25 ° C (1) ACD
logd 7.20 ph 2; TEMP: 25 ° C (1) ACD
logd 8.20 ph 3; TEMP: 25 ° C (1) ACD
logd 8.69 PH 4; TEMP: 25 ° C (1) ACD
logd 8.79 ph 5; TEMP: 25 ° C (1) ACD
logd 8.79 PH 6; TEMP: 25 ° C (1) ACD
logd 8.71 PH 7; TEMP: 25 ° C (1) ACD
logd 8.27 PH 8; TEMP: 25 ° C (1) ACD
logd 7.49 ph 9; TEMP: 25 ° C (1) ACD
logd 6.95 ph 10; TEMP: 25 ° C (1) ACD
Logp 8.803 ± 0.766 TEMP: 25 ° C (1) ACD
Mass Interrincic solubility 5.4 x 10-5 g / l TEMP: 25 ° C (1) ACD
Mass Slisedity 0.051 g / l ph 1; TEMP: 25 ° C (1) ACD
Mass Slisedity 1.9 x 10-3 g / l ph 2; TEMP: 25 ° C (1) ACD
Mass Slisedity 1.9 x 10-4 g / l ph 3; TEMP: 25 ° C (1) ACD
Mass Slisedity 6.0 x 10-5 g / l PH 4; TEMP: 25 ° C (1) ACD
Mass Slisedity 4.8 x 10-5 g / l ph 5; TEMP: 25 ° C (1) ACD
Mass Slisedity 4.8 x 10-5 g / l PH 6; TEMP: 25 ° C (1) ACD
Mass Slisedity 5.8 x 10-5 g / l PH 7; TEMP: 25 ° C (1) ACD
Mass Slisedity 1.6 x 10-4 g / l PH 8; TEMP: 25 ° C (1) ACD
Mass Slisedity 9.3 x 10-4 g / l ph 9; TEMP: 25 ° C (1) ACD
Mass Slisedity 3.6 x 10-3 g / l ph 10; TEMP: 25 ° C (1) ACD
Mass Slisedity 5.7 x 10-5 g / l Ph 6 6.97; TEMP: 25 ° C (1) ACD
Molala oa Molala oa Molala 5.8 x 10-8 MOL / L TEMP: 25 ° C (1) ACD
Molala ea lla 5.5 x 10-5 mol / L ph 1; TEMP: 25 ° C (1) ACD
Molala ea lla 2.0 x 10-6 mol / L ph 2; TEMP: 25 ° C (1) ACD

 

Thepa Boleng Boemo Mohloli
Molala ea lla 2.0 x 10-7 Mol / L ph 3; TEMP: 25 ° C (1) ACD
Molala ea lla 6.4 x 10-8 MOL / L PH 4; TEMP: 25 ° C (1) ACD
Molala ea lla 5.1 x 10-8 MOL / L ph 5; TEMP: 25 ° C (1) ACD
Molala ea lla 5.1 x 10-8 MOL / L PH 6; TEMP: 25 ° C (1) ACD
Molala ea lla 6.2 x 10-8 MOL / L PH 7; TEMP: 25 ° C (1) ACD
Molala ea lla 1.7 x 10-7 Mol / L PH 8; TEMP: 25 ° C (1) ACD
Molala ea lla 1.0 x 10-6 mol / L ph 9; TEMP: 25 ° C (1) ACD
Molala ea lla 3.9 x 10-6 mol / L ph 10; TEMP: 25 ° C (1) ACD
Molala ea lla 6.1 x 10-8 MOL / L Ph 6 6.97; TEMP: 25 ° C (1) ACD
Boima ba Molecular 932.01    
pka 7.87 ± 0.43 Boholo ba tempele ea acidic: 25 ° C (1) ACD
pka 3.45 ± 0.70 Boholo ba mosebetsi oa mantlha: 25 ° C (1) ACD

.

LIPINSSKI

Thepa Boleng Boemo Mohloli
Li-litlama tse potolohileng ka bolokolohi 22   (1) ACD
H 16   (1) ACD
H donors 1   (1) ACD
H donor / Canot 17   (1) ACD
Logp 8.803 ± 0.766 TEMP: 25 ° C (1) ACD
Boima ba Molecular 932.01    

.

Sebopeho se amanang le

Thepa Boleng Mohloli oa Boemo
Sebaka sa polar. 187 A2 (1) ACD

.

SIRCTRA e boletsoeng esale pele

Spectra e fumanehang
1 h nmr
13 c nmr

Lipolelo tsa GHS Harpeur

Mohloli oa Polelo ea Code Harver
H302 Kotsi e Kotsi Haeba e Metsoa European Agency (ECHA) Selali le Labeding

Setsi sa "Tloaelo e Khethiloeng le Labeli"

Khetho ea likheo le ho ngolana - likheo tsa ho tsebisoa le ho ngolisa - tsebiso e matla haholo


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