N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide
N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | F938-0051 |
| Compound Name: | N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C20 H14 Cl F N4 O2 S |
| Smiles: | C(c1ccc(cc1)F)n1c(nc(n1)[Cl])Sc1ccccc1NC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3565 |
| logD: | 4.3565 |
| logSw: | -4.5656 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.041 |
| InChI Key: | OCCSUIWPDSSAKI-UHFFFAOYSA-N |