3-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]propanamide
3-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | C191-0499 |
| Compound Name: | 3-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 542.63 |
| Molecular Formula: | C28 H38 N4 O7 |
| Smiles: | COc1cc2C(N(CCC(NCC3CCCO3)=O)C(N(CC(NCCC3CCCCC=3)=O)c2cc1OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4742 |
| logD: | 1.4742 |
| logSw: | -2.1023 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.137 |
| InChI Key: | CHXLGRZMJCSQQV-HXUWFJFHSA-N |