1-{4-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperazin-1-yl}but-2-yn-1-one
Chemical Structure Depiction of
1-{4-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperazin-1-yl}but-2-yn-1-one
1-{4-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperazin-1-yl}but-2-yn-1-one
Compound characteristics
| Compound ID: | T002-0259 |
| Compound Name: | 1-{4-[1-(4-chlorobenzene-1-sulfonyl)cyclopropane-1-carbonyl]piperazin-1-yl}but-2-yn-1-one |
| Molecular Weight: | 394.88 |
| Molecular Formula: | C18 H19 Cl N2 O4 S |
| Smiles: | CC#CC(N1CCN(CC1)C(C1(CC1)S(c1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7611 |
| logD: | 1.7611 |
| logSw: | -2.7666 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.111 |
| InChI Key: | ZQMWBFPPARDEHG-UHFFFAOYSA-N |