![7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile structure](/static/products/1124/112434-50-1.webp)
7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
TL;DR: 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile (CAS 112434-50-1) is a chemical compound with molecular formula C14H10N4O2S and molecular weight 298.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-amino-4-oxo-5-phenyl-2-sulfanylidene-1,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile
Also Known As: 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile, 7-AMINO-4-OXO-5-PHENYL-2-THIOXO-1,3,5,8-TETRAHYDRO-8-OXAQUINAZOLINE-6-CARBONITRILE, 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile, 7-amino-4-oxo-5-phenyl-2-thioxo-1,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile, 2H-Pyrano[2,3-d]pyrimidine-6-carbonitrile, 7-amino-1,3,4,5-tetrahydro-4-oxo-5-phenyl-2-thioxo-
| Molecular Formula | C14H10N4O2S |
|---|---|
| Molecular Weight | 298.05 g/mol |
| LogP | 1.65067 |
| Topological Polar Surface Area | 107.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.05246 |
| Heavy Atoms | 21 |
| Complexity | 889.67053 |
Chemical Identifiers
| CAS Number | 112434-50-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)NC(=S)N3)N)C#N |
Product Overview
7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile (CAS 112434-50-1), with molecular formula C14H10N4O2S and molecular weight 298.05 g/mol. IUPAC: 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile.
Chemical Property Profile of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Property Insights of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
The XLogP value of 1.65067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile. The TPSA of 107.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile. Following Lipinski's Rule of Five, 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile has 3 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 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile?
The CAS number of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile is 112434-50-1.
What is the molecular formula of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile?
The molecular formula of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile is C14H10N4O2S.
What is the molecular weight of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile?
The molecular weight of 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile is 298.05 g/mol.
Where can I buy 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile?
You can request a quote for 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 7-amino-4-oxo-5-phenyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-6-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.