[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone
Chemical Structure Depiction of
[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone
[5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone
Compound characteristics
| Compound ID: | D481-2252 |
| Compound Name: | [5-amino-3-(3,4-dimethylphenyl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C21 H18 N4 O |
| Smiles: | Cc1ccc(cc1C)c1nc(N)n(C(c2cccc3ccccc23)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5442 |
| logD: | 4.5442 |
| logSw: | -4.7779 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.575 |
| InChI Key: | PWBRAAHRKUNHJX-UHFFFAOYSA-N |