4-(3-{1-[3-(morpholin-4-yl)-3-oxopropyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
Chemical Structure Depiction of
4-(3-{1-[3-(morpholin-4-yl)-3-oxopropyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
4-(3-{1-[3-(morpholin-4-yl)-3-oxopropyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
Compound characteristics
| Compound ID: | L701-0566 |
| Compound Name: | 4-(3-{1-[3-(morpholin-4-yl)-3-oxopropyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile |
| Molecular Weight: | 429.44 |
| Molecular Formula: | C22 H19 N7 O3 |
| Smiles: | C(Cn1c2ccc(cc2nn1)c1nc(c2ccc(C#N)cc2)on1)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.976 |
| logD: | 1.976 |
| logSw: | -2.372 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 98.406 |
| InChI Key: | SWJGQKBAJVFJPE-UHFFFAOYSA-N |