7-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-0818 |
| Compound Name: | 7-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 533.05 |
| Molecular Formula: | C25 H29 Cl N4 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCC(CC1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)(=O)=O)OCC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7282 |
| logD: | 2.7277 |
| logSw: | -3.5407 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.128 |
| InChI Key: | GUJXCLDXBLVCNK-UHFFFAOYSA-N |