methyl 4-({6-[(4-fluorophenyl)methyl]-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({6-[(4-fluorophenyl)methyl]-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl}amino)benzoate
methyl 4-({6-[(4-fluorophenyl)methyl]-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl}amino)benzoate
Compound characteristics
| Compound ID: | G804-0098 |
| Compound Name: | methyl 4-({6-[(4-fluorophenyl)methyl]-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl}amino)benzoate |
| Molecular Weight: | 391.4 |
| Molecular Formula: | C22 H18 F N3 O3 |
| Smiles: | COC(c1ccc(cc1)NC1c2c(cccn2)C(N1Cc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7431 |
| logD: | 3.7431 |
| logSw: | -3.9863 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.085 |
| InChI Key: | JKYPOQGBVQFTAU-FQEVSTJZSA-N |