ABT-737 ,852808-04-9 _Chemical Cloud Database

ABT-737

Basic Information
Product Name：	ABT-737
CAS：	852808-04-9
English Synonyms：	4-[4-[(4'-CHLORO[1,1'-BIPHENYL]-2-YL)METHYL]-1-PIPERAZINYL]-N-[[4-[[(1R)-3-(DIMETHYLAMINO)-1-[(PHENYLTHIO)METHYL]PROPYL]AMINO]-3-NITROPHENYL]SULFONYL]BENZAMIDE ; ABT-737 ; ABT 737 ; ABT737
MDL Number.：	MFCD12756212
H bond acceptor：	11
H bond donor：	2
Smile：	CN(C)CC[C@H](CSc1ccccc1)Nc2ccc(cc2[N+](=O)[O-])S(=O)(=O)NC(=O)c3ccc(cc3)N4CCN(CC4)Cc5ccccc5c6ccc(cc6)Cl
InChi：	InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1
InChiKey：	InChIKey=HPLNQCPCUACXLM-PGUFJCEWSA-N
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