2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-4-methylquinoline
Chemical Structure Depiction of
2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-4-methylquinoline
2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-4-methylquinoline
Compound characteristics
| Compound ID: | Y501-4857 |
| Compound Name: | 2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-4-methylquinoline |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C21 H27 N5 O2 S |
| Smiles: | CCn1c(C)c(c(C)n1)S(N1CCN(CC1)c1cc(C)c2ccccc2n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1397 |
| logD: | 3.1259 |
| logSw: | -3.0663 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.282 |
| InChI Key: | ICGUWEKYVRWKBY-UHFFFAOYSA-N |