N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | L150-0212 |
| Compound Name: | N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C21 H17 Cl N4 O2 S |
| Smiles: | C(Cn1c(nc(n1)[Cl])Sc1ccccc1NC(c1ccco1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5565 |
| logD: | 4.5565 |
| logSw: | -4.6922 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.019 |
| InChI Key: | YXJMFBQPPUUEIW-UHFFFAOYSA-N |