2-{[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide
2-{[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | V005-8826 |
| Compound Name: | 2-{[5-benzyl-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C24 H30 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)N(C(C)C)C(CSc1nnc(Cc2ccccc2)n1c1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0047 |
| logD: | 4.0046 |
| logSw: | -4.2439 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.84 |
| InChI Key: | RYLKDYSWIIXGHD-UHFFFAOYSA-N |