1-(4-{4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(4-{4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
1-(4-{4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | Y504-5328 |
| Compound Name: | 1-(4-{4-[(3,4-dimethoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one |
| Molecular Weight: | 459.56 |
| Molecular Formula: | C23 H29 N3 O5 S |
| Smiles: | COc1ccc(CN2CCN(CC2)S(c2ccc(cc2)N2CCCC2=O)(=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.0495 |
| logD: | 1.9543 |
| logSw: | -2.7481 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.567 |
| InChI Key: | ADQSKLKEJOMHIT-UHFFFAOYSA-N |