1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)piperidine
Chemical Structure Depiction of
1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)piperidine
1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)piperidine
Compound characteristics
Compound ID: | P939-3123 |
Compound Name: | 1-(4-chloro-3-methylbenzene-1-sulfonyl)-4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)piperidine |
Molecular Weight: | 380.89 |
Molecular Formula: | C17 H21 Cl N4 O2 S |
Smiles: | Cc1cc(ccc1[Cl])S(N1CCC(CC1)n1cnnc1C1CC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5424 |
logD: | 3.5366 |
logSw: | -3.6616 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 56.657 |
InChI Key: | YFCIRPBPDOQVTK-UHFFFAOYSA-N |