6-methyl-7-[4-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-methyl-7-[4-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-methyl-7-[4-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | G805-0891 |
| Compound Name: | 6-methyl-7-[4-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 421.51 |
| Molecular Formula: | C20 H27 N3 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCC(CC1)C(N1CCCCC1)=O)(=O)=O)OCC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3766 |
| logD: | 1.3761 |
| logSw: | -2.3132 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.868 |
| InChI Key: | IEBSPTXHLWVIPE-UHFFFAOYSA-N |