1-(azepan-1-yl)-3-{5-[5-(1H-indol-4-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-(1H-indol-4-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
1-(azepan-1-yl)-3-{5-[5-(1H-indol-4-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one
Compound characteristics
| Compound ID: | L701-0798 |
| Compound Name: | 1-(azepan-1-yl)-3-{5-[5-(1H-indol-4-yl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazol-1-yl}propan-1-one |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C25 H25 N7 O2 |
| Smiles: | C1CCCN(CC1)C(CCn1c2ccc(cc2nn1)c1nc(c2cccc3c2cc[nH]3)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8436 |
| logD: | 3.8436 |
| logSw: | -4.0955 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.553 |
| InChI Key: | JDAIUVLFKRJYBR-UHFFFAOYSA-N |