methyl 3-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}thiophene-2-carboxylate
methyl 3-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y200-1044 |
| Compound Name: | methyl 3-{[2-(2-chlorophenyl)quinoline-4-carbonyl]amino}thiophene-2-carboxylate |
| Molecular Weight: | 422.89 |
| Molecular Formula: | C22 H15 Cl N2 O3 S |
| Smiles: | COC(c1c(ccs1)NC(c1cc(c2ccccc2[Cl])nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3924 |
| logD: | 5.3699 |
| logSw: | -5.9067 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.883 |
| InChI Key: | XIACIBKEGXSDAO-UHFFFAOYSA-N |