N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2-methoxybenzamide
N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | G717-1545 |
| Compound Name: | N-{2-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]ethyl}-2-methoxybenzamide |
| Molecular Weight: | 356.81 |
| Molecular Formula: | C18 H17 Cl N4 O2 |
| Smiles: | COc1ccccc1C(NCCc1nc(c2ccc(cc2)[Cl])[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3292 |
| logD: | 3.3167 |
| logSw: | -4.0697 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.899 |
| InChI Key: | XMYGYIZXDWSGRJ-UHFFFAOYSA-N |