4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperidine
Chemical Structure Depiction of
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperidine
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperidine
Compound characteristics
| Compound ID: | S517-1018 |
| Compound Name: | 4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperidine |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C20 H25 N5 O3 S |
| Smiles: | Cc1c(c(C)on1)S(N1CCC(CC1)Cc1nncn1Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9623 |
| logD: | 1.9623 |
| logSw: | -2.3681 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.048 |
| InChI Key: | NKBUGPVHBYOQFF-UHFFFAOYSA-N |