6-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropane-1-sulfonyl]-2-methyl-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropane-1-sulfonyl]-2-methyl-2H-1,4-benzothiazin-3(4H)-one
6-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropane-1-sulfonyl]-2-methyl-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E511-1322 |
| Compound Name: | 6-[3-(4-cyclohexylpiperazin-1-yl)-3-oxopropane-1-sulfonyl]-2-methyl-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 465.63 |
| Molecular Formula: | C22 H31 N3 O4 S2 |
| Smiles: | CC1C(Nc2cc(ccc2S1)S(CCC(N1CCN(CC1)C1CCCCC1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1708 |
| logD: | 1.8722 |
| logSw: | -2.8779 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.367 |
| InChI Key: | XLZKAVXPVCGMRU-MRXNPFEDSA-N |