2-{[4-(5-chloro-2-methylphenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of
2-{[4-(5-chloro-2-methylphenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
2-{[4-(5-chloro-2-methylphenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
Compound characteristics
| Compound ID: | V010-8622 |
| Compound Name: | 2-{[4-(5-chloro-2-methylphenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 428.94 |
| Molecular Formula: | C21 H21 Cl N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1n1c(c2ccco2)nnc1SCC(N(CC=C)CC=C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3885 |
| logD: | 4.3882 |
| logSw: | -4.5424 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.174 |
| InChI Key: | VLUKVVJSXRTMAR-UHFFFAOYSA-N |