6-benzyl-7-(3-chloro-4-methoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
6-benzyl-7-(3-chloro-4-methoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
6-benzyl-7-(3-chloro-4-methoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
Compound ID: | C612-0375 |
Compound Name: | 6-benzyl-7-(3-chloro-4-methoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
Molecular Weight: | 379.84 |
Molecular Formula: | C21 H18 Cl N3 O2 |
Smiles: | COc1ccc(cc1[Cl])NC1c2c(cccn2)C(N1Cc1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0133 |
logD: | 4.0133 |
logSw: | -4.3899 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.541 |
InChI Key: | IDTFGKCWMIMYIA-FQEVSTJZSA-N |