3-[2-{2-[(butan-2-yl)amino]-2-oxoethyl}-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-cyclohexylpropanamide
Chemical Structure Depiction of
3-[2-{2-[(butan-2-yl)amino]-2-oxoethyl}-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-cyclohexylpropanamide
3-[2-{2-[(butan-2-yl)amino]-2-oxoethyl}-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-cyclohexylpropanamide
Compound characteristics
| Compound ID: | L940-0018 |
| Compound Name: | 3-[2-{2-[(butan-2-yl)amino]-2-oxoethyl}-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-cyclohexylpropanamide |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C24 H32 N6 O4 |
| Smiles: | CCC(C)NC(CN1C(N2C(=N1)N(CCC(NC1CCCCC1)=O)C(c1ccccc12)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1449 |
| logD: | 2.1449 |
| logSw: | -2.8525 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.295 |
| InChI Key: | PWAUJWACJIZGMZ-INIZCTEOSA-N |