2-[(azepan-1-yl)methyl]-6-(4-bromophenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-[(azepan-1-yl)methyl]-6-(4-bromophenyl)pyridazin-3(2H)-one
2-[(azepan-1-yl)methyl]-6-(4-bromophenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | Y041-5741 |
| Compound Name: | 2-[(azepan-1-yl)methyl]-6-(4-bromophenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 362.27 |
| Molecular Formula: | C17 H20 Br N3 O |
| Smiles: | C1CCCN(CC1)CN1C(C=CC(c2ccc(cc2)[Br])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0756 |
| logD: | 3.8377 |
| logSw: | -4.1567 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.305 |
| InChI Key: | KVENSOUAIYQBOA-UHFFFAOYSA-N |