HIT ID: HIT212099325
Cas No: 1261395-96-3
分子式: C24H26N2O5
分子量: 427.512
常用名: 4-Hydroxyphenyl Carvedilol-d5
氢键受体数 (HBA): 6
氢键供体数 (HBD): 4
LogP: 2.8772461
IUPAC: 4-(2-{[3-(9H-carbazol-4-yloxy)-2-hydroxy(1,1,2,3,3-2H5)propyl]amino}ethoxy)-3-methoxyphenol
IUPAC: 4-(2-{[3-(9H-carbazol-4-yloxy)-2-hydroxy(1,1,2,3,3-2H5)propyl]amino}ethoxy)-3-methoxyphenol
SMILES: [2H]C([2H])(NCCOc1ccc(O)cc1OC)C([2H])(O)C([2H])([2H])Oc1cccc2[nH]c3ccccc3c12
SMILES: [2H]C([2H])(NCCOc1ccc(O)cc1OC)C([2H])(O)C([2H])([2H])Oc1cccc2[nH]c3ccccc3c12
InChI key: ZCJHEORDHXCJNB-SUPLBRQZSA-N