HBV/HDV-IN-3
HIT218849621
sdf文件结构编辑类似物检索
HIT ID: HIT218849621
Cas No: 2883679-03-4
分子式: C28H27BrF3N5O3
分子量: 618.455
常用名: HBV/HDV-IN-3
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-[(6R)-7-[4-bromo-3-(trifluoromethyl)benzoyl]-2-{[(2S)-but-3-en-2-yl]amino}-6-methyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl]-N-methylbenzamide
IUPAC: 4-[(6R)-7-[4-bromo-3-(trifluoromethyl)benzoyl]-2-{[(2S)-but-3-en-2-yl]amino}-6-methyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl]-N-methylbenzamide
SMILES: CNC(=O)c1ccc(cc1)-n1c(N[C@@H](C)C=C)nc2CN([C@H](C)Cc2c1=O)C(=O)c1ccc(Br)c(c1)C(F)(F)F
SMILES: CNC(=O)c1ccc(cc1)-n1c(N[C@@H](C)C=C)nc2CN([C@H](C)Cc2c1=O)C(=O)c1ccc(Br)c(c1)C(F)(F)F
InChI key: PRQDPKBIQDENOT-JKSUJKDBSA-N
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