3-[1-(2-ethylbenzene-1-sulfonyl)piperidin-2-yl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
Chemical Structure Depiction of
3-[1-(2-ethylbenzene-1-sulfonyl)piperidin-2-yl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
3-[1-(2-ethylbenzene-1-sulfonyl)piperidin-2-yl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
Compound characteristics
| Compound ID: | S892-0450 |
| Compound Name: | 3-[1-(2-ethylbenzene-1-sulfonyl)piperidin-2-yl]-1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C20 H27 N3 O3 S |
| Smiles: | CCc1ccccc1S(N1CCCCC1c1c2COCCc2n(C)n1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9606 |
| logD: | 2.9606 |
| logSw: | -3.2515 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.494 |
| InChI Key: | VSVOWLFPGNLPTD-SFHVURJKSA-N |