(2-chlorophenyl)methyl 4-(4H-1,2,4-triazol-4-yl)benzoate
Chemical Structure Depiction of
(2-chlorophenyl)methyl 4-(4H-1,2,4-triazol-4-yl)benzoate
(2-chlorophenyl)methyl 4-(4H-1,2,4-triazol-4-yl)benzoate
Compound characteristics
| Compound ID: | 8016-3369 |
| Compound Name: | (2-chlorophenyl)methyl 4-(4H-1,2,4-triazol-4-yl)benzoate |
| Molecular Weight: | 313.74 |
| Molecular Formula: | C16 H12 Cl N3 O2 |
| Smiles: | C(c1ccccc1[Cl])OC(c1ccc(cc1)n1cnnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.385 |
| logD: | 3.385 |
| logSw: | -3.6433 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.128 |
| InChI Key: | VRGZLWZWXQOUNN-UHFFFAOYSA-N |