HIT ID: HIT218701037
Cas No:
分子式: C22H21N3O4
分子量: 395.451
常用名: N-(3-ethynylphenyl)(10,10,11,11-2H4)-7H,8H,13H,14H-1,4,7,10-tetraoxacyclododeca[2,3-g]quinazolin-4-amine, Icotinib-d4
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-(3-ethynylphenyl)(10,10,11,11-2H4)-7H,8H,10H,11H,13H,14H-1,4,7,10-tetraoxacyclododeca[2,3-g]quinazolin-4-amine
SMILES: [2H]C1([2H])OCCOc2cc3ncnc(Nc4cccc(c4)C#C)c3cc2OCCOC1([2H])[2H]
InChI key: QQLKULDARVNMAL-KXGHAPEVSA-N