N-[2-(azepan-1-yl)ethyl]-6-methoxy-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-6-methoxy-2H-1-benzopyran-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-6-methoxy-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-0244 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-6-methoxy-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 330.43 |
| Molecular Formula: | C19 H26 N2 O3 |
| Smiles: | COc1ccc2c(C=C(CO2)C(NCCN2CCCCCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8961 |
| logD: | 0.4514 |
| logSw: | -3.2677 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.721 |
| InChI Key: | YPIOSXYIJPBTSR-UHFFFAOYSA-N |