1-(azepan-1-yl)-3-{5-[5-(3-fluoro-4-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-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
1-(azepan-1-yl)-3-{5-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Compound characteristics
| Compound ID: | L701-0836 |
| Compound Name: | 1-(azepan-1-yl)-3-{5-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C24 H25 F N6 O2 |
| Smiles: | Cc1ccc(cc1F)c1nc(c2ccc3c(c2)nnn3CCC(N2CCCCCC2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.5654 |
| logD: | 4.5654 |
| logSw: | -4.4155 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.772 |
| InChI Key: | HEBMYWYFYCCETC-UHFFFAOYSA-N |