1-(azepan-1-yl)-3-{5-[5-(4-methoxy-2-methylphenyl)-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-methoxy-2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
1-(azepan-1-yl)-3-{5-[5-(4-methoxy-2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Compound characteristics
| Compound ID: | L701-0805 |
| Compound Name: | 1-(azepan-1-yl)-3-{5-[5-(4-methoxy-2-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one |
| Molecular Weight: | 460.54 |
| Molecular Formula: | C25 H28 N6 O3 |
| Smiles: | Cc1cc(ccc1c1nc(c2ccc3c(c2)nnn3CCC(N2CCCCCC2)=O)no1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3355 |
| logD: | 4.3355 |
| logSw: | -4.3111 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.316 |
| InChI Key: | VWIMECQKBQDSIH-UHFFFAOYSA-N |