N-{[4-(3-chlorophenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-{[4-(3-chlorophenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide
N-{[4-(3-chlorophenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | C592-0707 |
| Compound Name: | N-{[4-(3-chlorophenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide |
| Molecular Weight: | 474.95 |
| Molecular Formula: | C19 H15 Cl N6 O3 S2 |
| Smiles: | C(c1nnc(n1c1cccc(c1)[Cl])SCC(Nc1nccs1)=O)NC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.525 |
| logD: | 2.5246 |
| logSw: | -3.349 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.58 |
| InChI Key: | AYLLPTVSLIKOHD-UHFFFAOYSA-N |