methyl 2-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo-1,4-dihydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo-1,4-dihydroquinoline-3-carboxylate
methyl 2-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo-1,4-dihydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | G023-0773 |
| Compound Name: | methyl 2-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo-1,4-dihydroquinoline-3-carboxylate |
| Molecular Weight: | 432.88 |
| Molecular Formula: | C20 H17 Cl N2 O5 S |
| Smiles: | COC(C1=C(Nc2ccccc2C1=O)SCC(Nc1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6994 |
| logD: | 2.3357 |
| logSw: | -4.0381 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.494 |
| InChI Key: | MVTTYMLHUIQJKZ-UHFFFAOYSA-N |