5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile
TL;DR: 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile (CAS 866019-05-8) is a chemical compound with molecular formula C12H14BrN3O and molecular weight 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-4,6-dimethyl-2-morpholin-4-ylpyridine-3-carbonitrile
Also Known As: 5-bromo-4,6-dimethyl-2-morpholinonicotinonitrile, 5-bromo-4,6-dimethyl-2-(morpholin-4-yl)pyridine-3-carbonitrile, 5-bromo-4,6-dimethyl-2-morpholin-4-ylpyridine-3-carbonitrile, 5-bromo-4,6-dimethyl-2-morpholino-pyridine-3-carbonitrile, 5-Bromo-4,6-dimethyl-2-(4-morpholinyl)-3-pyridinecarbonitrile
| Molecular Formula | C12H14BrN3O |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 2.16922 |
| Topological Polar Surface Area | 49.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 295.032 |
| Heavy Atoms | 17 |
| Complexity | 475.61957 |
Chemical Identifiers
| CAS Number | 866019-05-8 |
|---|---|
| SMILES | CC1=C(C(=NC(=C1Br)C)N2CCOCC2)C#N |
Product Overview
5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile (CAS 866019-05-8), with molecular formula C12H14BrN3O and molecular weight 295.03 g/mol. IUPAC: 5-bromo-4,6-dimethyl-2-morpholin-4-ylpyridine-3-carbonitrile.
Chemical Property Profile of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile
Property Insights of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile
The XLogP value of 2.16922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile. With a topological polar surface area (TPSA) of 49.15 Ų, 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile 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 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile?
The CAS number of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile is 866019-05-8.
What is the molecular formula of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile?
The molecular formula of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile is C12H14BrN3O.
What is the molecular weight of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile?
The molecular weight of 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile is 295.03 g/mol.
Where can I buy 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile?
You can request a quote for 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-4,6-dimethyl-2-morpholinonicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.