![6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile structure](/static/products/904/904005-25-0.png)
6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
TL;DR: 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile (CAS 904005-25-0) is a chemical compound with molecular formula C17H16ClN3O2 and molecular weight 329.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C17H16ClN3O2 |
|---|---|
| Molecular Weight | 329.09 g/mol |
| LogP | 2.79608 |
| Topological Polar Surface Area | 81.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 329.0931 |
| Heavy Atoms | 23 |
| Complexity | 876.6822 |
Chemical Identifiers
| CAS Number | 904005-25-0 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=O)N(C(=C2C#N)N)C3=CC=C(C=C3)Cl)C |
Product Overview
6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile (CAS 904005-25-0), with molecular formula C17H16ClN3O2 and molecular weight 329.09 g/mol. IUPAC: 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Property Insights of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
The XLogP value of 2.79608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile. The TPSA of 81.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile 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 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
The CAS number of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is 904005-25-0.
What is the molecular formula of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
The molecular formula of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is C17H16ClN3O2.
What is the molecular weight of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
The molecular weight of 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is 329.09 g/mol.
Where can I buy 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
You can request a quote for 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-7-(4-chlorophenyl)-3,3-dimethyl-8-oxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.