3-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[2-(1H-imidazol-4-yl)ethyl]propanamide
Chemical Structure Depiction of
3-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[2-(1H-imidazol-4-yl)ethyl]propanamide
3-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[2-(1H-imidazol-4-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | Y043-5169 |
| Compound Name: | 3-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[2-(1H-imidazol-4-yl)ethyl]propanamide |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C25 H25 N5 O5 |
| Smiles: | COc1ccc2C3N(CCC(NCCc4c[nH]cn4)=O)C(c4ccccc4N3C(c2c1OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7833 |
| logD: | 0.6855 |
| logSw: | -2.1524 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.156 |
| InChI Key: | JIZXTPSMGPORLD-HSZRJFAPSA-N |