![[3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide structure](/static/products/1375/137500-42-6.webp)
[3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide
TL;DR: [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide (CAS 137500-42-6) is a chemical compound with molecular formula C9H16N4O and molecular weight 196.13242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide
Also Known As: Marsidomine, Darsidomine, Darsidomine [INN], KST-1B0359, 3-(cis-2,6-dimethylpiperidino)sydnonimine
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H16N4O |
| Molecular Weight | 196.13242 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.13242 Da |
| Heavy Atoms | 14 |
| Complexity | 266.0 |
| SMILES | C[C@@H]1CCC[C@@H](N1[N+]2=NOC(=[N-])C2)C |
| InChIKey | MLFRXXQBXBQMKQ-OCAPTIKFSA-N |
Chemical Property Profile of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide
Property Insights of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide. With a topological polar surface area (TPSA) of 28.8 Ų, [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide?
The CAS number of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide is 137500-42-6.
What is the molecular formula of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide?
The molecular formula of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide is C9H16N4O.
What is the molecular weight of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide?
The molecular weight of [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide is 196.13242 g/mol.
Where can I buy [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide?
You can request a quote for [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide?
Yes, CoreyChem provides custom synthesis services for [3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-4H-oxadiazol-3-ium-5-ylidene]azanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.