5-Cyano-6-cyclohexyl-2-thiouracil
TL;DR: 5-Cyano-6-cyclohexyl-2-thiouracil (CAS 290313-19-8) is a chemical compound with molecular formula C11H13N3OS and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-cyclohexyl-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
Also Known As: 5-Cyano-6-cyclohexyl-2-thiouracil, Maybridge1_006482, 6-Cyclohexyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile, 4-CYCLOHEXYL-2-MERCAPTO-6-OXO-1,6-DIHYDROPYRIMIDINE-5-CARBONITRILE, 6-cyclohexyl-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
| Molecular Formula | C11H13N3OS |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 2.35187 |
| Topological Polar Surface Area | 72.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.07793 |
| Heavy Atoms | 16 |
| Complexity | 531.3863 |
Chemical Identifiers
| CAS Number | 290313-19-8 |
|---|---|
| SMILES | C1CCC(CC1)C2=C(C(=O)NC(=S)N2)C#N |
Product Overview
5-Cyano-6-cyclohexyl-2-thiouracil (CAS 290313-19-8), with molecular formula C11H13N3OS and molecular weight 235.08 g/mol. IUPAC: 6-cyclohexyl-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile.
Chemical Property Profile of 5-Cyano-6-cyclohexyl-2-thiouracil
Property Insights of 5-Cyano-6-cyclohexyl-2-thiouracil
The XLogP value of 2.35187 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Cyano-6-cyclohexyl-2-thiouracil. The TPSA of 72.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Cyano-6-cyclohexyl-2-thiouracil. Following Lipinski's Rule of Five, 5-Cyano-6-cyclohexyl-2-thiouracil has 2 hydrogen bond donor(s) and 3 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 5-Cyano-6-cyclohexyl-2-thiouracil?
The CAS number of 5-Cyano-6-cyclohexyl-2-thiouracil is 290313-19-8.
What is the molecular formula of 5-Cyano-6-cyclohexyl-2-thiouracil?
The molecular formula of 5-Cyano-6-cyclohexyl-2-thiouracil is C11H13N3OS.
What is the molecular weight of 5-Cyano-6-cyclohexyl-2-thiouracil?
The molecular weight of 5-Cyano-6-cyclohexyl-2-thiouracil is 235.08 g/mol.
Where can I buy 5-Cyano-6-cyclohexyl-2-thiouracil?
You can request a quote for 5-Cyano-6-cyclohexyl-2-thiouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Cyano-6-cyclohexyl-2-thiouracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Cyano-6-cyclohexyl-2-thiouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.