N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-4-methylbenzamide
N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | C301-9478 |
| Compound Name: | N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-4-methylbenzamide |
| Molecular Weight: | 310.36 |
| Molecular Formula: | C16 H18 N6 O |
| Smiles: | CCn1c(C)c(c(n1)n1cnnc1)NC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0584 |
| logD: | -0.5508 |
| logSw: | -2.119 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.6 |
| InChI Key: | LNNHYEVQEAUNID-UHFFFAOYSA-N |