1-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one
1-(3,4-dimethylphenyl)-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: | L701-0032 |
| Compound Name: | 1-(3,4-dimethylphenyl)-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: | 499.57 |
| Molecular Formula: | C27 H29 N7 O3 |
| Smiles: | Cc1ccc(cc1C)N1CC(CC1=O)c1nc(c2ccc3c(c2)nnn3CCC(N2CCCC2)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0665 |
| logD: | 4.0665 |
| logSw: | -4.0986 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 90.557 |
| InChI Key: | DLYQZMYPMSPRBN-HXUWFJFHSA-N |