N-[5-(adamantan-1-yl)-1,3-thiazol-2-yl]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[5-(adamantan-1-yl)-1,3-thiazol-2-yl]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-[5-(adamantan-1-yl)-1,3-thiazol-2-yl]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8016-9782 |
| Compound Name: | N-[5-(adamantan-1-yl)-1,3-thiazol-2-yl]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 465.64 |
| Molecular Formula: | C24 H27 N5 O S2 |
| Smiles: | Cn1c(c2ccccc2)nnc1SCC(Nc1ncc(C23CC4CC(CC(C4)C3)C2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0393 |
| logD: | 6.034 |
| logSw: | -5.5049 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.53 |
| InChI Key: | PFBFMDZILXNOBU-UHFFFAOYSA-N |