![6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile structure](/static/products/903/903584-68-9.png)
6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
TL;DR: 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile (CAS 903584-68-9) is a chemical compound with molecular formula C18H19N3O2S and molecular weight 341.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C18H19N3O2S |
|---|---|
| Molecular Weight | 341.12 g/mol |
| LogP | 3.52057 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.1198 |
| Heavy Atoms | 24 |
| Complexity | 892.4506 |
Chemical Identifiers
| CAS Number | 903584-68-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=S)N(C(=C2C#N)N)C3=CC=C(C=C3)OC)C |
Product Overview
6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile (CAS 903584-68-9), with molecular formula C18H19N3O2S and molecular weight 341.12 g/mol. IUPAC: 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-sulfanylidene-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Property Insights of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
The XLogP value of 3.52057 indicates that 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile. Following Lipinski's Rule of Five, 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile has 1 hydrogen bond donor(s) and 5 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-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
The CAS number of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is 903584-68-9.
What is the molecular formula of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
The molecular formula of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is C18H19N3O2S.
What is the molecular weight of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
The molecular weight of 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile is 341.12 g/mol.
Where can I buy 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-3,4,7,8-tetrahydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile?
You can request a quote for 6-amino-7-(4-methoxyphenyl)-3,3-dimethyl-8-thioxo-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-methoxyphenyl)-3,3-dimethyl-8-thioxo-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-methoxyphenyl)-3,3-dimethyl-8-thioxo-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.