N-[3-(azepan-1-yl)propyl]-6-bromo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-6-bromo-2H-1-benzopyran-3-carboxamide
N-[3-(azepan-1-yl)propyl]-6-bromo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-1260 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-6-bromo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 393.32 |
| Molecular Formula: | C19 H25 Br N2 O2 |
| Smiles: | C1CCCN(CC1)CCCNC(C1COc2ccc(cc2C=1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7541 |
| logD: | 1.1834 |
| logSw: | -3.8182 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.177 |
| InChI Key: | ASZORQOTKQKWAK-UHFFFAOYSA-N |