1-(azepan-1-yl)-3-{5-[5-(6-chloropyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-{5-[5-(6-chloropyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
1-(azepan-1-yl)-3-{5-[5-(6-chloropyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Compound characteristics
| Compound ID: | L701-0802 |
| Compound Name: | 1-(azepan-1-yl)-3-{5-[5-(6-chloropyridin-3-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C22 H22 Cl N7 O2 |
| Smiles: | C1CCCN(CC1)C(CCn1c2ccc(cc2nn1)c1nc(c2ccc(nc2)[Cl])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3757 |
| logD: | 3.3757 |
| logSw: | -3.7092 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 82.776 |
| InChI Key: | UORRURQUVHLAFE-UHFFFAOYSA-N |