1-[2-methoxy-5-(3-methylpiperidine-1-sulfonyl)phenyl]-4-(2,4,5-trichlorobenzene-1-sulfonyl)piperazine
Chemical Structure Depiction of
1-[2-methoxy-5-(3-methylpiperidine-1-sulfonyl)phenyl]-4-(2,4,5-trichlorobenzene-1-sulfonyl)piperazine
1-[2-methoxy-5-(3-methylpiperidine-1-sulfonyl)phenyl]-4-(2,4,5-trichlorobenzene-1-sulfonyl)piperazine
Compound characteristics
| Compound ID: | V012-9598 |
| Compound Name: | 1-[2-methoxy-5-(3-methylpiperidine-1-sulfonyl)phenyl]-4-(2,4,5-trichlorobenzene-1-sulfonyl)piperazine |
| Molecular Weight: | 596.98 |
| Molecular Formula: | C23 H28 Cl3 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CC1CCCN(C1)S(c1ccc(c(c1)N1CCN(CC1)S(c1cc(c(cc1[Cl])[Cl])[Cl])(=O)=O)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3511 |
| logD: | 5.3511 |
| logSw: | -5.9448 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.184 |
| InChI Key: | ILMSYHNHFZHTGM-INIZCTEOSA-N |