2-(3-chloro-4-methoxyphenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-chloro-4-methoxyphenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one
2-(3-chloro-4-methoxyphenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | F897-0855 |
| Compound Name: | 2-(3-chloro-4-methoxyphenyl)-1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 454.97 |
| Molecular Formula: | C20 H27 Cl N4 O4 S |
| Smiles: | CCn1c(C)c(c(C)n1)S(N1CCN(CC1)C(Cc1ccc(c(c1)[Cl])OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4914 |
| logD: | 1.4914 |
| logSw: | -2.8634 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.787 |
| InChI Key: | BKWNPISMFSKBKF-UHFFFAOYSA-N |