1-(3-methylbenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine
Chemical Structure Depiction of
1-(3-methylbenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine
1-(3-methylbenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine
Compound characteristics
Compound ID: | P939-4621 |
Compound Name: | 1-(3-methylbenzene-1-sulfonyl)-4-(3-methyl-4H-1,2,4-triazol-4-yl)piperidine |
Molecular Weight: | 320.41 |
Molecular Formula: | C15 H20 N4 O2 S |
Smiles: | Cc1cccc(c1)S(N1CCC(CC1)n1cnnc1C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.7661 |
logD: | 1.766 |
logSw: | -2.4107 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 57.183 |
InChI Key: | YAYGSTSEHFFSKT-UHFFFAOYSA-N |