1-(2-methylphenyl)-N-(prop-2-en-1-yl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
1-(2-methylphenyl)-N-(prop-2-en-1-yl)-1H-1,2,4-triazole-3-carboxamide
1-(2-methylphenyl)-N-(prop-2-en-1-yl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | V017-2365 |
| Compound Name: | 1-(2-methylphenyl)-N-(prop-2-en-1-yl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 242.28 |
| Molecular Formula: | C13 H14 N4 O |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1cnc(C(NCC=C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6015 |
| logD: | 1.6015 |
| logSw: | -2.1253 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.403 |
| InChI Key: | HQBQSBBTXKAWFV-UHFFFAOYSA-N |