1-(4-methylphenyl)-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(4-methylphenyl)-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one
1-(4-methylphenyl)-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | L701-0035 |
| Compound Name: | 1-(4-methylphenyl)-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one |
| Molecular Weight: | 485.55 |
| Molecular Formula: | C26 H27 N7 O3 |
| Smiles: | Cc1ccc(cc1)N1CC(CC1=O)c1nc(c2ccc3c(c2)nnn3CCC(N2CCCC2)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3825 |
| logD: | 3.3824 |
| logSw: | -3.4147 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 90.557 |
| InChI Key: | ONVSQJQKFBDNNH-LJQANCHMSA-N |