ethyl 2-({[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}methyl)-4-oxo-1,4-dihydroquinoline-6-carboxylate
Chemical Structure Depiction of
ethyl 2-({[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}methyl)-4-oxo-1,4-dihydroquinoline-6-carboxylate
ethyl 2-({[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}methyl)-4-oxo-1,4-dihydroquinoline-6-carboxylate
Compound characteristics
| Compound ID: | G751-5365 |
| Compound Name: | ethyl 2-({[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}methyl)-4-oxo-1,4-dihydroquinoline-6-carboxylate |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C22 H21 Cl N2 O4 S |
| Smiles: | CCOC(c1ccc2c(c1)C(C=C(CSCC(Nc1ccc(C)c(c1)[Cl])=O)N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8018 |
| logD: | 5.6111 |
| logSw: | -5.9412 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.665 |
| InChI Key: | GSRHGGQVKPJUNZ-UHFFFAOYSA-N |