4-{2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-(4-methylpiperidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-(4-methylpiperidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-{2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-(4-methylpiperidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0480 |
| Compound Name: | 4-{2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-6-(4-methylpiperidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 542.65 |
| Molecular Formula: | C27 H34 N4 O6 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)N(CC(N1CCN(CC1)c1cccc(c1)OC)=O)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7204 |
| logD: | 2.7203 |
| logSw: | -3.4324 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.976 |
| InChI Key: | CFXCPYROBHZESE-UHFFFAOYSA-N |