4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)-1-(4-ethylbenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)-1-(4-ethylbenzene-1-sulfonyl)piperidine
4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)-1-(4-ethylbenzene-1-sulfonyl)piperidine
Compound characteristics
Compound ID: | P939-3096 |
Compound Name: | 4-(3-cyclopropyl-4H-1,2,4-triazol-4-yl)-1-(4-ethylbenzene-1-sulfonyl)piperidine |
Molecular Weight: | 360.48 |
Molecular Formula: | C18 H24 N4 O2 S |
Smiles: | CCc1ccc(cc1)S(N1CCC(CC1)n1cnnc1C1CC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2051 |
logD: | 3.1993 |
logSw: | -3.3439 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 56.657 |
InChI Key: | ZGPHMJHOZYDXPX-UHFFFAOYSA-N |