HIT ID: HIT218851472
Cas No: 2409841-51-4
分子式: C21H26BF2N3O7
分子量: 481.26
常用名: [(4S)-2-[(1R)-1-(2-{[(2S)-1-(2,4-difluorophenyl)azetidin-2-yl]formamido}acetamido)-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid
常用名: [(4S)-2-[(1R)-1-(2-{[(2S)-1-(2,4-difluorophenyl)azetidin-2-yl]formamido}acetamido)-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(4S)-2-[(1R)-1-(2-{[(2S)-1-(2,4-difluorophenyl)azetidin-2-yl]formamido}acetamido)-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid
IUPAC: 2-[(4S)-2-[(1R)-1-(2-{[(2S)-1-(2,4-difluorophenyl)azetidin-2-yl]formamido}acetamido)-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid
SMILES: CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCN1c1ccc(F)cc1F)B1O[C@@H](CC(O)=O)C(=O)O1
SMILES: CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCN1c1ccc(F)cc1F)B1O[C@@H](CC(O)=O)C(=O)O1
InChI key: BMSAGHWUHGTMIV-ULQDDVLXSA-N
