5-[(4-bromophenyl)methyl]-3-(4-methylphenyl)-1,2,4-triazin-6(1H)-one
Chemical Structure Depiction of
5-[(4-bromophenyl)methyl]-3-(4-methylphenyl)-1,2,4-triazin-6(1H)-one
5-[(4-bromophenyl)methyl]-3-(4-methylphenyl)-1,2,4-triazin-6(1H)-one
Compound characteristics
| Compound ID: | G879-1583 |
| Compound Name: | 5-[(4-bromophenyl)methyl]-3-(4-methylphenyl)-1,2,4-triazin-6(1H)-one |
| Molecular Weight: | 356.22 |
| Molecular Formula: | C17 H14 Br N3 O |
| Smiles: | Cc1ccc(cc1)C1N=C(Cc2ccc(cc2)[Br])C(NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0963 |
| logD: | 4.0962 |
| logSw: | -4.2427 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.308 |
| InChI Key: | HQRSMIJNEFZGQU-UHFFFAOYSA-N |