N-(3-methylbutyl)-1-(3-methylphenyl)-5-(2-phenylethyl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-1-(3-methylphenyl)-5-(2-phenylethyl)-1H-1,2,4-triazole-3-carboxamide
N-(3-methylbutyl)-1-(3-methylphenyl)-5-(2-phenylethyl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | V011-4060 |
| Compound Name: | N-(3-methylbutyl)-1-(3-methylphenyl)-5-(2-phenylethyl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C23 H28 N4 O |
| Salt: | not_available |
| Smiles: | CC(C)CCNC(c1nc(CCc2ccccc2)n(c2cccc(C)c2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3463 |
| logD: | 5.3463 |
| logSw: | -5.291 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.392 |
| InChI Key: | MSPYNNGAPMVPRO-UHFFFAOYSA-N |