ethyl 3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6,7-dimethylquinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6,7-dimethylquinoxaline-2-carboxylate
ethyl 3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6,7-dimethylquinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V001-5897 |
| Compound Name: | ethyl 3-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6,7-dimethylquinoxaline-2-carboxylate |
| Molecular Weight: | 510.66 |
| Molecular Formula: | C27 H34 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)S(N1CCN(CC1)c1c(C(=O)OCC)nc2cc(C)c(C)cc2n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7508 |
| logD: | 6.7508 |
| logSw: | -5.6168 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.6 |
| InChI Key: | FXIXHQKDTBRUSS-UHFFFAOYSA-N |