2,6-dimethyl-7-[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2,6-dimethyl-7-[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
2,6-dimethyl-7-[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0302 |
| Compound Name: | 2,6-dimethyl-7-[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 497.53 |
| Molecular Formula: | C24 H23 N3 O7 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCN(CC1)C(C1=Cc2ccccc2OC1=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7652 |
| logD: | 1.7646 |
| logSw: | -2.6129 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.936 |
| InChI Key: | YTHVEVCQNHWJRB-OAHLLOKOSA-N |