N-(2,4-dimethylphenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(2,4-dimethylphenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y508-3181 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-[(5-{[(naphthalen-1-yl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 493.63 |
| Molecular Formula: | C29 H27 N5 O S |
| Smiles: | Cc1ccc(c(C)c1)NC(CSc1nnc(CNc2cccc3ccccc23)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4909 |
| logD: | 5.4909 |
| logSw: | -6.5354 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.677 |
| InChI Key: | FGAPFOKAHXTVMJ-UHFFFAOYSA-N |