N-(2,4-difluorophenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
N-(2,4-difluorophenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | J084-0033 |
| Compound Name: | N-(2,4-difluorophenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 447.46 |
| Molecular Formula: | C23 H15 F2 N5 O S |
| Smiles: | C(C(Nc1ccc(cc1F)F)=O)Sc1nnc2c3ccccc3nc(c3ccccc3)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.671 |
| logD: | 4.6579 |
| logSw: | -4.6951 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.762 |
| InChI Key: | KJEMCPHTXXSEES-UHFFFAOYSA-N |