6-{4-[3-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-{4-[3-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one
6-{4-[3-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F537-0201 |
| Compound Name: | 6-{4-[3-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C22 H26 N4 O5 S |
| Smiles: | CC1C(Nc2cc(ccc2O1)S(N1CCN(CC1)C(c1cccc(c1)N(C)C)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.801 |
| logD: | 1.8008 |
| logSw: | -2.7404 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.819 |
| InChI Key: | JZTIKNFTTNOWAS-OAHLLOKOSA-N |