5-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
5-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carboxamide
5-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | V002-1821 |
| Compound Name: | 5-methyl-N-(3-methylbutyl)-1-(2-methylphenyl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C16 H22 N4 O |
| Salt: | not_available |
| Smiles: | CC(C)CCNC(c1nc(C)n(c2ccccc2C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0273 |
| logD: | 3.0273 |
| logSw: | -3.253 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.163 |
| InChI Key: | QYUFMTGSNKLEBB-UHFFFAOYSA-N |