4-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0736 |
| Compound Name: | 4-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-6-(morpholine-4-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 549.05 |
| Molecular Formula: | C25 H29 Cl N4 O6 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CN1C(COc2ccc(cc12)S(N1CCOCC1)(=O)=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4315 |
| logD: | 2.4315 |
| logSw: | -3.0277 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.04 |
| InChI Key: | ASKPTTCGDAECEL-UHFFFAOYSA-N |