2-methyl-6-[4-(3-phenylprop-2-enoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-methyl-6-[4-(3-phenylprop-2-enoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
2-methyl-6-[4-(3-phenylprop-2-enoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F537-0277 |
| Compound Name: | 2-methyl-6-[4-(3-phenylprop-2-enoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Smiles: | CC1C(Nc2cc(ccc2O1)S(N1CCN(CC1)C(/C=C/c1ccccc1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2684 |
| logD: | 2.2682 |
| logSw: | -3.084 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.487 |
| InChI Key: | HDFFJZTVCBWHDZ-MRXNPFEDSA-N |