N-(2,4-dimethylphenyl)-2-{[7-fluoro-4-(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-{[7-fluoro-4-(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
N-(2,4-dimethylphenyl)-2-{[7-fluoro-4-(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F367-0695 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-{[7-fluoro-4-(2-methylpropyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C23 H24 F N5 O2 S |
| Smiles: | CC(C)CN1C(c2cc(ccc2n2c1nnc2SCC(Nc1ccc(C)cc1C)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4692 |
| logD: | 4.4691 |
| logSw: | -4.2384 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.035 |
| InChI Key: | SBILUSFHEOILPV-UHFFFAOYSA-N |