N-(4-bromophenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
N-(4-bromophenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | G373-3268 |
| Compound Name: | N-(4-bromophenyl)-1-[(3-methoxyphenyl)methyl]-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 437.29 |
| Molecular Formula: | C21 H17 Br N4 O2 |
| Smiles: | COc1cccc(Cn2c3ccc(cc3nn2)C(Nc2ccc(cc2)[Br])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2862 |
| logD: | 4.2812 |
| logSw: | -4.4171 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.299 |
| InChI Key: | WDWRCHGGHSEERT-UHFFFAOYSA-N |