1-(4-{4-[(3-methoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(4-{4-[(3-methoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
1-(4-{4-[(3-methoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | Y504-5237 |
| Compound Name: | 1-(4-{4-[(3-methoxyphenyl)methyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C22 H27 N3 O4 S |
| Smiles: | COc1cccc(CN2CCN(CC2)S(c2ccc(cc2)N2CCCC2=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5318 |
| logD: | 2.3714 |
| logSw: | -2.8268 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.85 |
| InChI Key: | PTRPUVGMVAQALL-UHFFFAOYSA-N |