1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one
1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | F897-0868 |
| Compound Name: | 1-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethan-1-one |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C20 H28 N4 O4 S |
| Smiles: | CCn1c(C)c(c(C)n1)S(N1CCN(CC1)C(COc1cccc(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0856 |
| logD: | 1.0856 |
| logSw: | -2.3438 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.655 |
| InChI Key: | KVIVTTHHUOWLFD-UHFFFAOYSA-N |