methyl 2-{[2-(2,4-dichlorophenyl)-3-methylquinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2,4-dichlorophenyl)-3-methylquinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{[2-(2,4-dichlorophenyl)-3-methylquinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3365-2657 |
| Compound Name: | methyl 2-{[2-(2,4-dichlorophenyl)-3-methylquinoline-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 525.45 |
| Molecular Formula: | C27 H22 Cl2 N2 O3 S |
| Smiles: | Cc1c(C(Nc2c(C(=O)OC)c3CCCCc3s2)=O)c2ccccc2nc1c1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.4318 |
| logD: | 4.9577 |
| logSw: | -6.5869 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.048 |
| InChI Key: | LZXKDWUMNHJAIM-UHFFFAOYSA-N |