7-(2-fluoro-5-nitroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(2-fluoro-5-nitroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(2-fluoro-5-nitroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | G804-1460 |
| Compound Name: | 7-(2-fluoro-5-nitroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 408.39 |
| Molecular Formula: | C21 H17 F N4 O4 |
| Smiles: | COc1ccc(CN2C(c3c(cccn3)C2=O)Nc2cc(ccc2F)[N+]([O-])=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6849 |
| logD: | 3.6849 |
| logSw: | -4.0164 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.138 |
| InChI Key: | UACLGMVPQNDGLW-FQEVSTJZSA-N |