6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F537-0041 |
| Compound Name: | 6-[4-(5-bromofuran-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 470.3 |
| Molecular Formula: | C17 H16 Br N3 O6 S |
| Smiles: | C1CN(CCN1C(c1ccc(o1)[Br])=O)S(c1ccc2c(c1)NC(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2787 |
| logD: | 1.2785 |
| logSw: | -2.542 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.602 |
| InChI Key: | KAMRMVMJOGGMNZ-UHFFFAOYSA-N |