methyl 3-[(2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]thiophene-2-carboxylate
methyl 3-[(2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G491-0494 |
| Compound Name: | methyl 3-[(2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]thiophene-2-carboxylate |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C22 H18 N2 O5 S |
| Smiles: | COC(c1c(ccs1)NC(C1=CC2=C(CC(CC2=O)c2ccccc2)NC1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.071 |
| logD: | -0.7129 |
| logSw: | -3.3791 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.649 |
| InChI Key: | SPBQPGPXHQABPO-ZDUSSCGKSA-N |