4-[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-(2-methoxyethyl)butanamide
Chemical Structure Depiction of
4-[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-(2-methoxyethyl)butanamide
4-[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-(2-methoxyethyl)butanamide
Compound characteristics
| Compound ID: | C191-0453 |
| Compound Name: | 4-[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-(2-methoxyethyl)butanamide |
| Molecular Weight: | 530.62 |
| Molecular Formula: | C27 H38 N4 O7 |
| Smiles: | COCCNC(CCCN1C(c2cc(c(cc2N(CC(NCCC2CCCCC=2)=O)C1=O)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0995 |
| logD: | 1.0995 |
| logSw: | -2.0609 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.938 |
| InChI Key: | MCOFSPKBIMCBKA-UHFFFAOYSA-N |