HIT ID: HIT218833232
Cas No: 192140-58-2
分子式: C28H18F2K5N3O14
分子量: 853.947
常用名: pentapotassium 2-{6-[bis(carboxylatomethyl)amino]-5-(2-{6-[bis(carboxylatomethyl)amino]-2,3-difluorophenoxy}ethoxy)-1-benzofuran-2-yl}-1,3-oxazole-5-carboxylate
常用名: pentapotassium 2-{6-[bis(carboxylatomethyl)amino]-5-(2-{6-[bis(carboxylatomethyl)amino]-2,3-difluorophenoxy}ethoxy)-1-benzofuran-2-yl}-1,3-oxazole-5-carboxylate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: pentapotassium 2-{6-[bis(carboxylatomethyl)amino]-5-(2-{6-[bis(carboxylatomethyl)amino]-2,3-difluorophenoxy}ethoxy)-1-benzofuran-2-yl}-1,3-oxazole-5-carboxylate
IUPAC: pentapotassium 2-{6-[bis(carboxylatomethyl)amino]-5-(2-{6-[bis(carboxylatomethyl)amino]-2,3-difluorophenoxy}ethoxy)-1-benzofuran-2-yl}-1,3-oxazole-5-carboxylate
SMILES: [K+].[K+].[K+].[K+].[K+].[O-]C(=O)CN(CC([O-])=O)c1ccc(F)c(F)c1OCCOc1cc2cc(oc2cc1N(CC([O-])=O)CC([O-])=O)-c1ncc(o1)C([O-])=O
SMILES: [K+].[K+].[K+].[K+].[K+].[O-]C(=O)CN(CC([O-])=O)c1ccc(F)c(F)c1OCCOc1cc2cc(oc2cc1N(CC([O-])=O)CC([O-])=O)-c1ncc(o1)C([O-])=O
InChI key: LZFKAYBOWPHSOE-UHFFFAOYSA-I
