N-(4-{[(4-benzyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(4-{[(4-benzyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)acetamide
N-(4-{[(4-benzyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | 8019-4005 |
| Compound Name: | N-(4-{[(4-benzyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C16 H17 N5 O S2 |
| Smiles: | CC(Nc1nc(CSc2nnc(C)n2Cc2ccccc2)cs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8299 |
| logD: | 2.8223 |
| logSw: | -3.1965 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.821 |
| InChI Key: | WNVBUEDIHHZAAY-UHFFFAOYSA-N |