methyl 4-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-4-oxobutanoate
methyl 4-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-4-oxobutanoate
Compound characteristics
| Compound ID: | V015-1649 |
| Compound Name: | methyl 4-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-4-oxobutanoate |
| Molecular Weight: | 543.68 |
| Molecular Formula: | C28 H37 N3 O6 S |
| Salt: | not_available |
| Smiles: | COC(CCC(N1CCN(CC1)c1cc(ccc1OC)S(N1CCC(CC1)Cc1ccccc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9214 |
| logD: | 3.9214 |
| logSw: | -4.1247 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.239 |
| InChI Key: | SJFURBKONHFMOB-UHFFFAOYSA-N |