6-[(thiophen-2-yl)methyl]-7-(3,4,5-trimethoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
6-[(thiophen-2-yl)methyl]-7-(3,4,5-trimethoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
6-[(thiophen-2-yl)methyl]-7-(3,4,5-trimethoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C612-0873 |
| Compound Name: | 6-[(thiophen-2-yl)methyl]-7-(3,4,5-trimethoxyanilino)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC1c2c(cccn2)C(N1Cc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8392 |
| logD: | 2.8392 |
| logSw: | -3.4685 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.907 |
| InChI Key: | QDNKEIACSYMLFV-FQEVSTJZSA-N |