1-benzyl-N-(3-chloro-4-methoxyphenyl)-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-benzyl-N-(3-chloro-4-methoxyphenyl)-1H-benzotriazole-5-carboxamide
1-benzyl-N-(3-chloro-4-methoxyphenyl)-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L455-0947 |
| Compound Name: | 1-benzyl-N-(3-chloro-4-methoxyphenyl)-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 392.84 |
| Molecular Formula: | C21 H17 Cl N4 O2 |
| Smiles: | COc1ccc(cc1[Cl])NC(c1ccc2c(c1)nnn2Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9076 |
| logD: | 3.8948 |
| logSw: | -4.4319 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.386 |
| InChI Key: | MLSJQSRAMZUWOD-UHFFFAOYSA-N |