N-(2,5-difluorophenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
N-(2,5-difluorophenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F367-0667 |
| Compound Name: | N-(2,5-difluorophenyl)-2-[(7-fluoro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetamide |
| Molecular Weight: | 447.44 |
| Molecular Formula: | C20 H16 F3 N5 O2 S |
| Smiles: | CCCN1C(c2cc(ccc2n2c1nnc2SCC(Nc1cc(ccc1F)F)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7019 |
| logD: | 3.6938 |
| logSw: | -3.8889 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.014 |
| InChI Key: | XAKGPKMZOPFKBY-UHFFFAOYSA-N |