3-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-6-methyl[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-6-methyl[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
3-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-6-methyl[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | Y501-6656 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-6-methyl[1,2]oxazolo[5,4-b]pyridine-4-carboxamide |
| Molecular Weight: | 472.52 |
| Molecular Formula: | C25 H20 N4 O4 S |
| Smiles: | Cc1cc(C(Nc2c(C#N)c3CCCCCc3s2)=O)c2c(c3ccc4c(c3)OCO4)noc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.1653 |
| logD: | 3.6599 |
| logSw: | -5.0627 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.07 |
| InChI Key: | LWINYZMOSDMBEP-UHFFFAOYSA-N |