4-methoxy-6-phenyl-1H-pyrimidine-2-thione
TL;DR: 4-methoxy-6-phenyl-1H-pyrimidine-2-thione (CAS 352666-91-2) is a chemical compound with molecular formula C11H10N2OS and molecular weight 218.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-6-phenyl-1H-pyrimidine-2-thione
Also Known As: ML100 Analog, 4-methoxy-6-phenyl-1H-pyrimidine-2-thione, 4-methoxy-6-phenyl-2-pyrimidinethiol, 2(1H)-Pyrimidinethione, 6-methoxy-4-phenyl-, 4-Methoxy-6-phenylpyrimidine-2(1H)-thione
| Molecular Formula | C11H10N2OS |
|---|---|
| Molecular Weight | 218.05 g/mol |
| LogP | 2.81479 |
| Topological Polar Surface Area | 37.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.05139 |
| Heavy Atoms | 15 |
| Complexity | 507.4964 |
Chemical Identifiers
| CAS Number | 352666-91-2 |
|---|---|
| SMILES | COC1=NC(=S)NC(=C1)C2=CC=CC=C2 |
Product Overview
4-methoxy-6-phenyl-1H-pyrimidine-2-thione (CAS 352666-91-2), with molecular formula C11H10N2OS and molecular weight 218.05 g/mol. IUPAC: 4-methoxy-6-phenyl-1H-pyrimidine-2-thione.
Chemical Property Profile of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione
Property Insights of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione
The XLogP value of 2.81479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methoxy-6-phenyl-1H-pyrimidine-2-thione. With a topological polar surface area (TPSA) of 37.91 Ų, 4-methoxy-6-phenyl-1H-pyrimidine-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methoxy-6-phenyl-1H-pyrimidine-2-thione has 1 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 4-methoxy-6-phenyl-1H-pyrimidine-2-thione?
The CAS number of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione is 352666-91-2.
What is the molecular formula of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione?
The molecular formula of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione is C11H10N2OS.
What is the molecular weight of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione?
The molecular weight of 4-methoxy-6-phenyl-1H-pyrimidine-2-thione is 218.05 g/mol.
Where can I buy 4-methoxy-6-phenyl-1H-pyrimidine-2-thione?
You can request a quote for 4-methoxy-6-phenyl-1H-pyrimidine-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-6-phenyl-1H-pyrimidine-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-6-phenyl-1H-pyrimidine-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.