4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-3-methylphenyl acetate
Chemical Structure Depiction of
4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-3-methylphenyl acetate
4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-3-methylphenyl acetate
Compound characteristics
| Compound ID: | 4334-1311 |
| Compound Name: | 4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-3-methylphenyl acetate |
| Molecular Weight: | 296.28 |
| Molecular Formula: | C16 H12 N2 O4 |
| Smiles: | CC(=O)Oc1ccc(c(C)c1)N1C(c2cccnc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9999 |
| logD: | 0.9999 |
| logSw: | -1.9947 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.239 |
| InChI Key: | RQLNBVQOFLQFJP-UHFFFAOYSA-N |