4-({[4-ethyl-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
4-({[4-ethyl-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
4-({[4-ethyl-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V025-7379 |
| Compound Name: | 4-({[4-ethyl-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide |
| Molecular Weight: | 360.52 |
| Molecular Formula: | C19 H28 N4 O S |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1ccc(CSc2nnc(C(C)C)n2CC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0432 |
| logD: | 3.0418 |
| logSw: | -3.0376 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.638 |
| InChI Key: | XUMMVBGSCYQNFA-UHFFFAOYSA-N |