CAS 532430-75-4 - C14H12N4O2S2
TL;DR: CAS 532430-75-4 - C14H12N4O2S2 (CAS 532430-75-4) is a chemical compound with molecular formula C14H12N4O2S2 and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Also Known As: 2-{[(4,6-DIOXO-2-SULFANYLIDENE-1,3-DIAZINAN-5-YLIDENE)METHYL]AMINO}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE
| Molecular Formula | C14H12N4O2S2 |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 2.70067 |
| Topological Polar Surface Area | 105.03 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.04016 |
| Heavy Atoms | 22 |
| Complexity | 914.3899 |
Chemical Identifiers
| CAS Number | 532430-75-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)N=CC3=C(NC(=S)NC3=O)O)C#N |
Product Overview
CAS 532430-75-4 - C14H12N4O2S2 (CAS 532430-75-4), with molecular formula C14H12N4O2S2 and molecular weight 332.04 g/mol. IUPAC: 2-[(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile.
Chemical Property Profile of CAS 532430-75-4 - C14H12N4O2S2
Property Insights of CAS 532430-75-4 - C14H12N4O2S2
The XLogP value of 2.70067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 532430-75-4 - C14H12N4O2S2. The TPSA of 105.03 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 532430-75-4 - C14H12N4O2S2. Following Lipinski's Rule of Five, CAS 532430-75-4 - C14H12N4O2S2 has 3 hydrogen bond donor(s) and 6 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 CAS 532430-75-4 - C14H12N4O2S2?
The CAS number of CAS 532430-75-4 - C14H12N4O2S2 is 532430-75-4.
What is the molecular formula of CAS 532430-75-4 - C14H12N4O2S2?
The molecular formula of CAS 532430-75-4 - C14H12N4O2S2 is C14H12N4O2S2.
What is the molecular weight of CAS 532430-75-4 - C14H12N4O2S2?
The molecular weight of CAS 532430-75-4 - C14H12N4O2S2 is 332.04 g/mol.
Where can I buy CAS 532430-75-4 - C14H12N4O2S2?
You can request a quote for CAS 532430-75-4 - C14H12N4O2S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 532430-75-4 - C14H12N4O2S2?
Yes, KEHONG BIO provides custom synthesis services for CAS 532430-75-4 - C14H12N4O2S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.