HIT ID: HIT103481730
Cas No: 67273-56-7
分子式: C16H16N2
分子量: 236.318
常用名: NADH-IN-2
氢键受体数 (HBA): 2
氢键供体数 (HBD): 1
LogP: 5.09
IUPAC: 2-[4-(propan-2-yl)phenyl]-1H-1,3-benzodiazole
IUPAC: 2-[4-(propan-2-yl)phenyl]-1H-1,3-benzodiazole
SMILES: CC(C)c1ccc(cc1)-c1nc2ccccc2[nH]1
SMILES: CC(C)c1ccc(cc1)-c1nc2ccccc2[nH]1
InChI key: KZLWMCPIYIDTTK-UHFFFAOYSA-N