4-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}-4-oxobutanoic acid
4-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | Y205-8094 |
| Compound Name: | 4-{4-[4-(2-methylpropyl)benzene-1-sulfonyl]piperazin-1-yl}-4-oxobutanoic acid |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C18 H26 N2 O5 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCN(CC1)C(CCC(O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8258 |
| logD: | -1.1236 |
| logSw: | -2.4493 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.534 |
| InChI Key: | WYAKRMCGKSCGDY-UHFFFAOYSA-N |