1-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-(phenylsulfanyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-(phenylsulfanyl)ethan-1-one
1-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-(phenylsulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | V006-5175 |
| Compound Name: | 1-{4-[5-(4-benzylpiperidine-1-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-(phenylsulfanyl)ethan-1-one |
| Molecular Weight: | 579.78 |
| Molecular Formula: | C31 H37 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1N1CCN(CC1)C(CSc1ccccc1)=O)S(N1CCC(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8622 |
| logD: | 5.8622 |
| logSw: | -5.592 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.389 |
| InChI Key: | SEKPFNFYAAXVJN-UHFFFAOYSA-N |