HIT ID: HIT212686941
Cas No: 1065606-97-4
分子式: C25H26ClN7O2S2
分子量: 556.1
常用名: AR453588 hydrochloride
氢键受体数 (HBA): 7
氢键供体数 (HBD): 1
LogP: 2.8926995
IUPAC: 1-{4-[5-({3-[(2-methylpyridin-3-yl)oxy]-5-(pyridin-2-ylsulfanyl)pyridin-2-yl}amino)-1,2,4-thiadiazol-3-yl]piperidin-1-yl}ethan-1-one hydrochloride
IUPAC: 1-{4-[5-({3-[(2-methylpyridin-3-yl)oxy]-5-(pyridin-2-ylsulfanyl)pyridin-2-yl}amino)-1,2,4-thiadiazol-3-yl]piperidin-1-yl}ethan-1-one hydrochloride
SMILES: Cl.CC(=O)N1CCC(CC1)c1nsc(Nc2ncc(Sc3ccccn3)cc2Oc2cccnc2C)n1
SMILES: Cl.CC(=O)N1CCC(CC1)c1nsc(Nc2ncc(Sc3ccccn3)cc2Oc2cccnc2C)n1
InChI key: DVXDJNBGXCILIU-UHFFFAOYSA-N
