7-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0060 |
| Compound Name: | 7-{4-[3-(4-methoxyphenyl)prop-2-enoyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C23 H25 N3 O6 S |
| Smiles: | Cc1cc2c(cc1S(N1CCN(CC1)C(/C=C/c1ccc(cc1)OC)=O)(=O)=O)OCC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8721 |
| logD: | 1.8715 |
| logSw: | -2.7691 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.692 |
| InChI Key: | AAIGCMFNIYYWSB-UHFFFAOYSA-N |