N-[4-(5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)phenyl]acetamide
Chemical Structure Depiction of
N-[4-(5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)phenyl]acetamide
N-[4-(5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | D481-2657 |
| Compound Name: | N-[4-(5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)phenyl]acetamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C24 H27 N5 O2 S |
| Smiles: | CC1CCN(CC1)C(CSc1nnc(c2ccc(cc2)NC(C)=O)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4604 |
| logD: | 3.4604 |
| logSw: | -3.7157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.367 |
| InChI Key: | AHLVFCNNDQTPOV-UHFFFAOYSA-N |