6-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Chemical Structure Depiction of
6-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
6-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Compound characteristics
| Compound ID: | E786-1923 |
| Compound Name: | 6-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione |
| Molecular Weight: | 405.49 |
| Molecular Formula: | C18 H19 N3 O4 S2 |
| Smiles: | C1CCCN(CC1)S(c1ccc(CN2C(c3cccnc3C2=O)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7295 |
| logD: | 1.7295 |
| logSw: | -2.7213 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.461 |
| InChI Key: | HYCXCHXFQOKCFG-UHFFFAOYSA-N |