6-[4-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-[4-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F537-0029 |
| Compound Name: | 6-[4-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 484.53 |
| Molecular Formula: | C23 H24 N4 O6 S |
| Smiles: | C1C(CN(C1=O)c1ccccc1)C(N1CCN(CC1)S(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5906 |
| logD: | 0.5904 |
| logSw: | -2.5456 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.426 |
| InChI Key: | WXAUQVPEVKHNSZ-INIZCTEOSA-N |