1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine
Chemical Structure Depiction of
1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine
1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine
Compound characteristics
| Compound ID: | S517-0692 |
| Compound Name: | 1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C16 H25 N5 O3 S |
| Smiles: | CC(C)n1cnnc1CC1CCN(CC1)S(c1c(C)noc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3329 |
| logD: | 1.3284 |
| logSw: | -1.5938 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.111 |
| InChI Key: | QBNPSBPVXFSHEA-UHFFFAOYSA-N |