2-{3-[1-methyl-3-(5-methyl-1,3-oxazol-2-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
Chemical Structure Depiction of
2-{3-[1-methyl-3-(5-methyl-1,3-oxazol-2-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
2-{3-[1-methyl-3-(5-methyl-1,3-oxazol-2-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
Compound characteristics
| Compound ID: | SC98-0007 |
| Compound Name: | 2-{3-[1-methyl-3-(5-methyl-1,3-oxazol-2-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C22 H25 N5 O4 S |
| Smiles: | Cc1cnc(c2c3CN(CCc3n(C)n2)C(c2cccc(c2)N2CCCCS2(=O)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 0.8681 |
| logD: | 0.8681 |
| logSw: | -2.0503 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.381 |
| InChI Key: | MPUKRYPRFHRFAJ-UHFFFAOYSA-N |