N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide
N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | F938-0369 |
| Compound Name: | N-(2-{[3-bromo-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)furan-2-carboxamide |
| Molecular Weight: | 469.36 |
| Molecular Formula: | C21 H17 Br N4 O2 S |
| Smiles: | C(Cn1c(nc(n1)[Br])Sc1ccccc1NC(c1ccco1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6839 |
| logD: | 4.6839 |
| logSw: | -4.6302 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.985 |
| InChI Key: | FBEFNHXZXQZUHB-UHFFFAOYSA-N |