N-(4-bromo-2-methylphenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(4-bromo-2-methylphenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G373-3269 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 451.32 |
| Molecular Formula: | C22 H19 Br N4 O2 |
| Smiles: | Cc1cc(ccc1NC(c1ccc2c(c1)nnn2Cc1cccc(c1)OC)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4688 |
| logD: | 4.4601 |
| logSw: | -4.4259 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.602 |
| InChI Key: | HUHYFFKIHQEAOX-UHFFFAOYSA-N |