2-{4-[1-(3-methoxypropyl)-3-(1,3-oxazol-4-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-{4-[1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
2-{4-[1-(3-methoxypropyl)-3-(1,3-oxazol-4-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: | SD01-0467 |
| Compound Name: | 2-{4-[1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C24 H29 N5 O5 S |
| Smiles: | COCCCn1c2CCN(Cc2c(c2cocn2)n1)C(c1ccc(cc1)N1CCCCS1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6519 |
| logD: | 0.6519 |
| logSw: | -2.0508 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.328 |
| InChI Key: | RHJUYFPXIXFBQF-UHFFFAOYSA-N |