HIT ID: HIT101044928

Cas No: 1112400-30-2

分子式: C21H15BrN4O3

分子量: 451.28

常用名: 2-[5-(4-bromophenoxymethyl)furan-2-yl]-5-[(pyridin-3-ylmethyl)amino]-1,3-oxazole-4-carbonitrile, D561-0775

氢键受体数 (HBA): 6

氢键供体数 (HBD): 1

LogP: 3.9044

IUPAC: 2-{5-[(4-bromophenoxy)methyl]furan-2-yl}-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile

SMILES: Brc1ccc(OCc2ccc(o2)-c2nc(C#N)c(NCc3cccnc3)o2)cc1

InChI key: DBRZPZIWXMNBCI-UHFFFAOYSA-N