![4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile structure](/static/products/706/70638-55-0.png)
4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile
TL;DR: 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile (CAS 70638-55-0) is a chemical compound with molecular formula C13H12N4OS and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-(dimethylamino)phenyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
Also Known As: ChemDiv3_007114, TQR960, IDI1_025024, 4-[4-(dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile, BRD-K70159463-001-01-2
| Molecular Formula | C13H12N4OS |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 2.03717 |
| Topological Polar Surface Area | 75.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.07318 |
| Heavy Atoms | 19 |
| Complexity | 749.9383 |
Chemical Identifiers
| CAS Number | 70638-55-0 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=C(C(=O)NC(=S)N2)C#N |
Product Overview
4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile (CAS 70638-55-0), with molecular formula C13H12N4OS and molecular weight 272.07 g/mol. IUPAC: 6-[4-(dimethylamino)phenyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile.
Chemical Property Profile of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile
Property Insights of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile
The XLogP value of 2.03717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile. The TPSA of 75.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile. Following Lipinski's Rule of Five, 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile has 2 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-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile?
The CAS number of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile is 70638-55-0.
What is the molecular formula of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile?
The molecular formula of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile is C13H12N4OS.
What is the molecular weight of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile?
The molecular weight of 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile is 272.07 g/mol.
Where can I buy 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile?
You can request a quote for 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(Dimethylamino)phenyl]-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.