1-(azepan-1-yl)-3-(5-{5-[1-(4-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-(5-{5-[1-(4-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one
1-(azepan-1-yl)-3-(5-{5-[1-(4-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0804 |
| Compound Name: | 1-(azepan-1-yl)-3-(5-{5-[1-(4-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one |
| Molecular Weight: | 486.57 |
| Molecular Formula: | C27 H30 N6 O3 |
| Smiles: | COc1ccc(cc1)C1(CC1)c1nc(c2ccc3c(c2)nnn3CCC(N2CCCCCC2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.1821 |
| logD: | 4.1821 |
| logSw: | -4.2642 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.567 |
| InChI Key: | YPDHDSWEWTVYIY-UHFFFAOYSA-N |