methyl 4-{2-[(4-methoxyphenyl)methyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(4-methoxyphenyl)methyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate
methyl 4-{2-[(4-methoxyphenyl)methyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | IB09-3763 |
| Compound Name: | methyl 4-{2-[(4-methoxyphenyl)methyl]-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}benzoate |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C27 H21 N O6 |
| Smiles: | COC(c1ccc(cc1)C1C2=C(C(N1Cc1ccc(cc1)OC)=O)Oc1ccccc1C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.34 |
| logD: | 4.34 |
| logSw: | -5.21 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 120.57 |
| InChI Key: | OUNQEVYAOAKMRK-HSZRJFAPSA-N |