HIT ID: HIT101717575
Cas No: 96315-11-6
分子式: C28H34N2O11
分子量: 574.583
常用名: BAPTA-TMFM
氢键受体数 (HBA): 16
氢键供体数 (HBD): 0
LogP: 1.9792
IUPAC: methyl 2-{[2-(2-{2-[bis(2-methoxy-2-oxoethyl)amino]-5-methylphenoxy}ethoxy)-4-formylphenyl](2-methoxy-2-oxoethyl)amino}acetate
IUPAC: methyl 2-{[2-(2-{2-[bis(2-methoxy-2-oxoethyl)amino]-5-methylphenoxy}ethoxy)-4-formylphenyl](2-methoxy-2-oxoethyl)amino}acetate
SMILES: COC(=O)CN(CC(=O)OC)c1ccc(C)cc1OCCOc1cc(C=O)ccc1N(CC(=O)OC)CC(=O)OC
SMILES: COC(=O)CN(CC(=O)OC)c1ccc(C)cc1OCCOc1cc(C=O)ccc1N(CC(=O)OC)CC(=O)OC
InChI key: GKTVRWOCZLYLJV-UHFFFAOYSA-N
