N-butyl-3-fluoro-N-{3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propyl}benzamide
Chemical Structure Depiction of
N-butyl-3-fluoro-N-{3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propyl}benzamide
N-butyl-3-fluoro-N-{3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propyl}benzamide
Compound characteristics
| Compound ID: | V008-8080 |
| Compound Name: | N-butyl-3-fluoro-N-{3-oxo-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propyl}benzamide |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C22 H23 F N4 O2 S |
| Smiles: | CCCCN(CCC(Nc1nnc(c2ccccc2)s1)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2303 |
| logD: | 4.23 |
| logSw: | -3.9963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.829 |
| InChI Key: | KBBYAHGMGHUOGV-UHFFFAOYSA-N |