N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-4-tert-butylbenzamide
Chemical Structure Depiction of
N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-4-tert-butylbenzamide
N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-4-tert-butylbenzamide
Compound characteristics
| Compound ID: | G717-2699 |
| Compound Name: | N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-4-tert-butylbenzamide |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C22 H26 N4 O |
| Smiles: | CC(C)(C)c1ccc(cc1)C(NCCc1nc(Cc2ccccc2)[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5025 |
| logD: | 4.5011 |
| logSw: | -4.3666 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.259 |
| InChI Key: | FIMWKSGYYAQFSI-UHFFFAOYSA-N |