Name: GW3965
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT214432781
Cas No:405911-09-3
常用名:GW3965
IUPAC:2-{3-[3-({[2-chloro-3-(trifluoromethyl)phenyl]methyl}(2,2-diphenylethyl)amino)propoxy]phenyl}-1-hydroxyethylidene 2-{3-[3-({[2-chloro-3-(trifluoromethyl)phenyl]methyl}(2,2-diphenylethyl)amino)propoxy]phenyl}ethaneperoxoate
IUPAC:2-{3-[3-({[2-chloro-3-(trifluoromethyl)phenyl]methyl}(2,2-diphenylethyl)amino)propoxy]phenyl}-1-hydroxyethylidene 2-{3-[3-({[2-chloro-3-(trifluoromethyl)phenyl]methyl}(2,2-diphenylethyl)amino)propoxy]phenyl}ethaneperoxoate
InChI key:VPQMTMQRVFRUBE-UHFFFAOYSA-N

分子式:C66H61Cl2F6N2O6
分子量:1163.11
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:OC(Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1)=[O]OC(=O)Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
SMILES:OC(Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1)=[O]OC(=O)Cc1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1

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