6-methyl-7-[3-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-methyl-7-[3-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-methyl-7-[3-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-0117 |
| Compound Name: | 6-methyl-7-[3-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C26 H29 N3 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCCC(C1)C(N1CCC(=CC1)c1ccccc1)=O)(=O)=O)OCC(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7552 |
| logD: | 2.7547 |
| logSw: | -3.3555 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.53 |
| InChI Key: | MRXBDNIFJIXFPO-NRFANRHFSA-N |