2-(2,5-dimethylanilino)-N-(2-methylcyclohexyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(2,5-dimethylanilino)-N-(2-methylcyclohexyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-(2,5-dimethylanilino)-N-(2-methylcyclohexyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E796-0298 |
| Compound Name: | 2-(2,5-dimethylanilino)-N-(2-methylcyclohexyl)-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 461.59 |
| Molecular Formula: | C25 H27 N5 O2 S |
| Smiles: | CC1CCCCC1NC(c1ccc2C(N3C(=Nc2c1)SC(Nc1cc(C)ccc1C)=N3)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6732 |
| logD: | 4.6629 |
| logSw: | -4.4359 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.698 |
| InChI Key: | JQUXAZCLUNNGDQ-UHFFFAOYSA-N |