![4-Mercaptopyrido[2,3-d]pyrimidine structure](/static/products/7815/78159-02-1.webp)
4-Mercaptopyrido[2,3-d]pyrimidine
TL;DR: 4-Mercaptopyrido[2,3-d]pyrimidine (CAS 78159-02-1) is a chemical compound with molecular formula C7H5N3S and molecular weight 163.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-pyrido[2,3-d]pyrimidine-4-thione
Also Known As: 4-mercaptopyrido[2,3-d]pyrimidine, LQDZBRVMVSRDTC-UHFFFAOYSA-, 1H-pyrido[2,3-d]pyrimidine-4-thione, Pyrido[2,3-d]pyrimidine-4(1H)-thione, Pyrido[2,3-d]pyrimidine-4(3H)-thione
| Molecular Formula | C7H5N3S |
|---|---|
| Molecular Weight | 163.02 g/mol |
| LogP | 1.68739 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.02042 |
| Heavy Atoms | 11 |
| Complexity | 429.3838 |
Chemical Identifiers
| CAS Number | 78159-02-1 |
|---|---|
| SMILES | C1=CC2=C(NC=NC2=S)N=C1 |
Product Overview
4-Mercaptopyrido[2,3-d]pyrimidine (CAS 78159-02-1), with molecular formula C7H5N3S and molecular weight 163.02 g/mol. IUPAC: 1H-pyrido[2,3-d]pyrimidine-4-thione.
Chemical Property Profile of 4-Mercaptopyrido[2,3-d]pyrimidine
Property Insights of 4-Mercaptopyrido[2,3-d]pyrimidine
The XLogP value of 1.68739 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Mercaptopyrido[2,3-d]pyrimidine. With a topological polar surface area (TPSA) of 41.57 Ų, 4-Mercaptopyrido[2,3-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Mercaptopyrido[2,3-d]pyrimidine 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-Mercaptopyrido[2,3-d]pyrimidine?
The CAS number of 4-Mercaptopyrido[2,3-d]pyrimidine is 78159-02-1.
What is the molecular formula of 4-Mercaptopyrido[2,3-d]pyrimidine?
The molecular formula of 4-Mercaptopyrido[2,3-d]pyrimidine is C7H5N3S.
What is the molecular weight of 4-Mercaptopyrido[2,3-d]pyrimidine?
The molecular weight of 4-Mercaptopyrido[2,3-d]pyrimidine is 163.02 g/mol.
Where can I buy 4-Mercaptopyrido[2,3-d]pyrimidine?
You can request a quote for 4-Mercaptopyrido[2,3-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Mercaptopyrido[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Mercaptopyrido[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.