2-{4-[4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine
Chemical Structure Depiction of
2-{4-[4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine
2-{4-[4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine
Compound characteristics
| Compound ID: | D122-0110 |
| Compound Name: | 2-{4-[4-(3-methylpiperidine-1-sulfonyl)benzene-1-sulfonyl]piperazin-1-yl}pyrimidine |
| Molecular Weight: | 465.59 |
| Molecular Formula: | C20 H27 N5 O4 S2 |
| Smiles: | CC1CCCN(C1)S(c1ccc(cc1)S(N1CCN(CC1)c1ncccn1)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5759 |
| logD: | 2.5759 |
| logSw: | -2.7254 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.216 |
| InChI Key: | YHKGGFGAAIKQJR-KRWDZBQOSA-N |