ethyl 6,7-dimethyl-3-{4-[3-(methylsulfanyl)propanoyl]piperazin-1-yl}quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 6,7-dimethyl-3-{4-[3-(methylsulfanyl)propanoyl]piperazin-1-yl}quinoxaline-2-carboxylate
ethyl 6,7-dimethyl-3-{4-[3-(methylsulfanyl)propanoyl]piperazin-1-yl}quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V029-8364 |
| Compound Name: | ethyl 6,7-dimethyl-3-{4-[3-(methylsulfanyl)propanoyl]piperazin-1-yl}quinoxaline-2-carboxylate |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C21 H28 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2cc(C)c(C)cc2n1)N1CCN(CC1)C(CCSC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7479 |
| logD: | 3.7479 |
| logSw: | -3.8499 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.281 |
| InChI Key: | YNIJZRZDFCXVCB-UHFFFAOYSA-N |