1-(azepan-1-yl)-3-{5-[5-(4-chloro-2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-{5-[5-(4-chloro-2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
1-(azepan-1-yl)-3-{5-[5-(4-chloro-2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Compound characteristics
| Compound ID: | L701-0801 |
| Compound Name: | 1-(azepan-1-yl)-3-{5-[5-(4-chloro-2-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one |
| Molecular Weight: | 480.95 |
| Molecular Formula: | C24 H25 Cl N6 O3 |
| Smiles: | COc1cc(ccc1c1nc(c2ccc3c(c2)nnn3CCC(N2CCCCCC2)=O)no1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7659 |
| logD: | 4.7659 |
| logSw: | -4.8038 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.402 |
| InChI Key: | KJZPPOOVBBHXIO-UHFFFAOYSA-N |