2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxamide
Chemical Structure Depiction of
2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxamide
2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxamide
Compound characteristics
| Compound ID: | M435-1575 |
| Compound Name: | 2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxamide |
| Molecular Weight: | 428.42 |
| Molecular Formula: | C20 H16 N2 O7 S |
| Smiles: | CC(c1cc2c(cc1NC(C1=C(c3c(C)c(C(C)=O)sc3NC1=O)O)=O)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4408 |
| logD: | -3.6929 |
| logSw: | -2.4647 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.252 |
| InChI Key: | GYUFZZNFXFGTPH-UHFFFAOYSA-N |