Alniditan dihydrochloride
HIT212712033
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HIT ID: HIT212712033
Cas No: 155428-00-5
分子式: C17H28Cl2N4O
分子量: 375.34
常用名: Alniditan dihydrochloride
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: 1.3143208
IUPAC: N-[3-({[(2R)-3,4-dihydro-2H-1-benzopyran-2-yl]methyl}amino)propyl]-1,4,5,6-tetrahydropyrimidin-2-amine dihydrochloride
IUPAC: N-[3-({[(2R)-3,4-dihydro-2H-1-benzopyran-2-yl]methyl}amino)propyl]-1,4,5,6-tetrahydropyrimidin-2-amine dihydrochloride
SMILES: Cl.Cl.C(CNC[C@H]1CCc2ccccc2O1)CNC1=NCCCN1 |t:18|
SMILES: Cl.Cl.C(CNC[C@H]1CCc2ccccc2O1)CNC1=NCCCN1 |t:18|
InChI key: GDNITZYKOOTAFK-QCUBGVIVSA-N
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