4-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0733 |
| Compound Name: | 4-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 528.63 |
| Molecular Formula: | C26 H32 N4 O6 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(CN1C(COc2ccc(cc12)S(N1CCOCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2725 |
| logD: | 2.2724 |
| logSw: | -2.7599 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.04 |
| InChI Key: | WDBDNCAPYRNHSX-UHFFFAOYSA-N |