N-(3-methylbutyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(3-methylbutyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-(3-methylbutyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0107 |
| Compound Name: | N-(3-methylbutyl)-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 272.35 |
| Molecular Formula: | C15 H20 N4 O |
| Smiles: | CC(C)CCNC(c1ccc(Cn2cncn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5581 |
| logD: | 1.5581 |
| logSw: | -2.066 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.742 |
| InChI Key: | GKROORUWBZMYRQ-UHFFFAOYSA-N |