2-{[4-(3-chlorophenyl)-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-(3-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide
2-{[4-(3-chlorophenyl)-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: | V017-5961 |
| Compound Name: | 2-{[4-(3-chlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 414.91 |
| Molecular Formula: | C20 H19 Cl N4 O2 S |
| Salt: | not_available |
| Smiles: | C=CCN(CC=C)C(CSc1nnc(c2ccco2)n1c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9397 |
| logD: | 3.9396 |
| logSw: | -4.2339 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.474 |
| InChI Key: | NKJAFBIPPSIVBX-UHFFFAOYSA-N |