4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile
TL;DR: 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile (CAS 64635-92-3) is a chemical compound with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-4-methyl-2,6-dioxopiperidine-3,5-dicarbonitrile
Also Known As: 2,4-Dicyano-3-butyl-3-methylglutarimide, 4-butyl-4-methyl-2,6-dioxopiperidine-3,5-dicarbonitrile, Glutarimide, 2,4-dicyano-3-butyl-3-methyl-, J3.708.711D, 0-22-00-00357 (Beilstein Handbook Reference)
| Molecular Formula | C12H15N3O2 |
|---|---|
| Molecular Weight | 233.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.11642 |
| Heavy Atoms | 17 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 64635-92-3 |
|---|---|
| SMILES | CCCCC1(C(C(=O)NC(=O)C1C#N)C#N)C |
| InChIKey | CBZUMPOKTUVIOS-UHFFFAOYSA-N |
Product Overview
4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile (CAS 64635-92-3), with molecular formula C12H15N3O2 and molecular weight 233.12 g/mol. IUPAC: 4-butyl-4-methyl-2,6-dioxopiperidine-3,5-dicarbonitrile.
Chemical Property Profile of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile
Property Insights of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile. Following Lipinski's Rule of Five, 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile has 1 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 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile?
The CAS number of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile is 64635-92-3.
What is the molecular formula of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile?
The molecular formula of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile is C12H15N3O2.
What is the molecular weight of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile?
The molecular weight of 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile is 233.12 g/mol.
Where can I buy 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile?
You can request a quote for 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Butyl-6-hydroxy-4-methyl-2-oxo-2,3,4,5-tetrahydropyridine-3,5-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.