N-[(5-methylfuran-2-yl)methyl]-7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxamide
N-[(5-methylfuran-2-yl)methyl]-7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxamide
Compound characteristics
| Compound ID: | S515-0735 |
| Compound Name: | N-[(5-methylfuran-2-yl)methyl]-7-oxo-2-[(pyridin-3-yl)methyl]azepane-2-carboxamide |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C19 H23 N3 O3 |
| Smiles: | Cc1ccc(CNC(C2(CCCCC(N2)=O)Cc2cccnc2)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5326 |
| logD: | 1.5324 |
| logSw: | -1.3259 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.535 |
| InChI Key: | XYEZGXGOTAKIMY-LJQANCHMSA-N |