7-[4-(azepane-1-sulfonyl)anilino]-6-benzyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-[4-(azepane-1-sulfonyl)anilino]-6-benzyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-[4-(azepane-1-sulfonyl)anilino]-6-benzyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C612-0387 |
| Compound Name: | 7-[4-(azepane-1-sulfonyl)anilino]-6-benzyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C26 H28 N4 O3 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(cc1)NC1c2c(cccn2)C(N1Cc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2166 |
| logD: | 4.2166 |
| logSw: | -4.2537 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.953 |
| InChI Key: | BVWYFRVBQUGQAG-VWLOTQADSA-N |