7-[4-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-chloro-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[4-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-chloro-2H-1,4-benzoxazin-3(4H)-one
7-[4-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-chloro-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-1298 |
| Compound Name: | 7-[4-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-chloro-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 532.06 |
| Molecular Formula: | C26 H30 Cl N3 O5 S |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.607 |
| logD: | 3.5484 |
| logSw: | -3.9364 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.596 |
| InChI Key: | MUCLZCXPAMWWCP-UHFFFAOYSA-N |