N-(4-chlorophenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(4-chlorophenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y500-1174 |
| Compound Name: | N-(4-chlorophenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 500.02 |
| Molecular Formula: | C27 H22 Cl N5 O S |
| Smiles: | C(c1nnc(n1c1ccccc1)SCC(Nc1ccc(cc1)[Cl])=O)Nc1cccc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.603 |
| logD: | 5.6029 |
| logSw: | -6.3713 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.375 |
| InChI Key: | QWASDZXJUGGRBX-UHFFFAOYSA-N |