6-chloro-7-{4-[3-(furan-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-7-{4-[3-(furan-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one
6-chloro-7-{4-[3-(furan-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0566 |
| Compound Name: | 6-chloro-7-{4-[3-(furan-2-yl)prop-2-enoyl]piperazine-1-sulfonyl}-2-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 465.91 |
| Molecular Formula: | C20 H20 Cl N3 O6 S |
| Smiles: | CC1C(Nc2cc(c(cc2O1)S(N1CCN(CC1)C(/C=C/c1ccco1)=O)(=O)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.88 |
| logD: | 1.8107 |
| logSw: | -2.9866 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.235 |
| InChI Key: | DCNISTMLQHCTFO-CYBMUJFWSA-N |