7-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one
7-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-1632 |
| Compound Name: | 7-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 547.07 |
| Molecular Formula: | C26 H31 Cl N4 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCCC(C1)C(N1CCN(CC1)c1cccc(c1)[Cl])=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.044 |
| logD: | 3.0433 |
| logSw: | -3.5106 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.4 |
| InChI Key: | RZKHJQHILIBDGA-UHFFFAOYSA-N |