HIT ID: HIT212666130
Cas No: 2366264-12-0
分子式: C20H27N3O2
分子量: 341.455
常用名: MS31
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 1.4637449
IUPAC: 1-[5-(aminomethyl)-3-[3-(2,3-dihydro-1H-isoindol-2-yl)propoxy]-2-methoxyphenyl]methanamine
IUPAC: 1-[5-(aminomethyl)-3-[3-(2,3-dihydro-1H-isoindol-2-yl)propoxy]-2-methoxyphenyl]methanamine
SMILES: COc1c(CN)cc(CN)cc1OCCCN1Cc2ccccc2C1
SMILES: COc1c(CN)cc(CN)cc1OCCCN1Cc2ccccc2C1
InChI key: XQQZNYFJATXWON-UHFFFAOYSA-N