2-(azepane-1-carbonyl)-4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
2-(azepane-1-carbonyl)-4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | L592-2045 |
| Compound Name: | 2-(azepane-1-carbonyl)-4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 498.69 |
| Molecular Formula: | C27 H38 N4 O3 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CN1C(C(C(N2CCCCCC2)=O)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2299 |
| logD: | 3.0675 |
| logSw: | -3.4347 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.806 |
| InChI Key: | YWYKHWUPTZLPOD-VWLOTQADSA-N |