N-benzyl-5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-benzyl-5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazole-3-carboxamide
N-benzyl-5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | D351-2634 |
| Compound Name: | N-benzyl-5-(4-methoxyphenyl)-1-phenyl-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 384.44 |
| Molecular Formula: | C23 H20 N4 O2 |
| Smiles: | COc1ccc(cc1)c1nc(C(NCc2ccccc2)=O)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3766 |
| logD: | 4.3766 |
| logSw: | -4.3819 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.846 |
| InChI Key: | XNVMRKYWUMEICF-UHFFFAOYSA-N |