3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride
TL;DR: 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride (CAS 75484-79-6) is a chemical compound with molecular formula C12H16ClN3S and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-4-thiomorpholin-4-ylpyridine-3-carbonitrile;hydrochloride
Also Known As: 3-Cyano-2,6-dimethyl-4-(4-thiomorpholinyl)pyridine hydrochloride, 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride, 2,6-Dimethyl-4-(4-thiomorpholinyl)-3-pyridinecarbonitrile monohydrochloride, 2,6-dimethyl-4-thiomorpholin-4-ylpyridine-3-carbonitrile hydrochloride, 2,6-Dimethyl-4-(thiomorpholin-4-yl)pyridine-3-carbonitrile--hydrogen chloride (1/1)
| Molecular Formula | C12H16ClN3S |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 2.54512 |
| Topological Polar Surface Area | 39.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.07535 |
| Heavy Atoms | 17 |
| Complexity | 436.11227 |
Chemical Identifiers
| CAS Number | 75484-79-6 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)C)C#N)N2CCSCC2.Cl |
Product Overview
3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride (CAS 75484-79-6), with molecular formula C12H16ClN3S and molecular weight 269.08 g/mol. IUPAC: 2,6-dimethyl-4-thiomorpholin-4-ylpyridine-3-carbonitrile;hydrochloride.
Chemical Property Profile of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride
Property Insights of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride
The XLogP value of 2.54512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride. With a topological polar surface area (TPSA) of 39.92 Ų, 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride 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
Frequently Asked Questions
What is the CAS number of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride?
The CAS number of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride is 75484-79-6.
What is the molecular formula of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride?
The molecular formula of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride is C12H16ClN3S.
What is the molecular weight of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride?
The molecular weight of 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride is 269.08 g/mol.
Where can I buy 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride?
You can request a quote for 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarbonitrile, 2,6-dimethyl-4-(4-thiomorpholinyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.