methyl 2-(ethylsulfanyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-(ethylsulfanyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate
methyl 2-(ethylsulfanyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | G023-0814 |
| Compound Name: | methyl 2-(ethylsulfanyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate |
| Molecular Weight: | 263.31 |
| Molecular Formula: | C13 H13 N O3 S |
| Smiles: | CCSC1=C(C(c2ccccc2N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7498 |
| logD: | 1.3713 |
| logSw: | -3.4596 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.986 |
| InChI Key: | XXNVOEHTTUCAQM-UHFFFAOYSA-N |