methyl 4-[7-methyl-3,9-dioxo-2-(pyridin-2-yl)-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl]benzoate
Chemical Structure Depiction of
methyl 4-[7-methyl-3,9-dioxo-2-(pyridin-2-yl)-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl]benzoate
methyl 4-[7-methyl-3,9-dioxo-2-(pyridin-2-yl)-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl]benzoate
Compound characteristics
| Compound ID: | 6872-5010 |
| Compound Name: | methyl 4-[7-methyl-3,9-dioxo-2-(pyridin-2-yl)-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl]benzoate |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C25 H18 N2 O5 |
| Smiles: | Cc1ccc2c(c1)C(C1C(c3ccc(cc3)C(=O)OC)N(C(C=1O2)=O)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2187 |
| logD: | 4.2187 |
| logSw: | -4.415 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.807 |
| InChI Key: | XGROCWLDXUWXPF-OAQYLSRUSA-N |