2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of
2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
Compound characteristics
| Compound ID: | V011-4913 |
| Compound Name: | 2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 424.95 |
| Molecular Formula: | C22 H21 Cl N4 O S |
| Salt: | not_available |
| Smiles: | C=CCN(CC=C)C(CSc1nnc(c2ccccc2[Cl])n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4915 |
| logD: | 4.4915 |
| logSw: | -4.6565 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.896 |
| InChI Key: | GRKLJFZTARSFOQ-UHFFFAOYSA-N |