6-chloro-7-[4-(cyclohexanecarbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-7-[4-(cyclohexanecarbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-chloro-7-[4-(cyclohexanecarbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0220 |
| Compound Name: | 6-chloro-7-[4-(cyclohexanecarbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 441.93 |
| Molecular Formula: | C19 H24 Cl N3 O5 S |
| Smiles: | C1CCC(CC1)C(N1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0769 |
| logD: | 2.0184 |
| logSw: | -2.9893 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.868 |
| InChI Key: | VSTMHAWHRQHCAA-UHFFFAOYSA-N |