1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-2,6-dimethylphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-2,6-dimethylphenyl)pyrrolidin-2-one
1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-2,6-dimethylphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | 8015-0867 |
| Compound Name: | 1-(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-2,6-dimethylphenyl)pyrrolidin-2-one |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C24 H29 N3 O5 S |
| Smiles: | Cc1cc(cc(C)c1N1CCCC1=O)S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4441 |
| logD: | 3.349 |
| logSw: | -3.7875 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.82 |
| InChI Key: | FGHRVFSJUODRRR-UHFFFAOYSA-N |