methyl 4-[3-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)propanamido]benzoate
methyl 4-[3-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | Y042-7207 |
| Compound Name: | methyl 4-[3-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)propanamido]benzoate |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C26 H21 N3 O5 |
| Smiles: | COC(c1ccc(cc1)NC(CCN1C2c3ccccc3C(N2c2ccccc2C1=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1252 |
| logD: | 3.1251 |
| logSw: | -3.6685 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.025 |
| InChI Key: | FHRXAOLHHLTACC-HSZRJFAPSA-N |