1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione
TL;DR: 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione (CAS 120614-05-3) is a chemical compound with molecular formula C5H4N4S and molecular weight 152.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydropyrazolo[4,5-d]pyrimidine-7-thione
Also Known As: J1.596.601G, 1,4-dihydropyrazolo[4,3-d]pyrimidine-7-thione, 1H,6H,7H-pyrazolo[4,3-d]pyrimidine-7-thione, 1,6-Dihydro-7H-pyrazolo[4,3-d]pyrimidine-7-thione, 7h-pyrazolo[4,3-d]pyrimidine-7-thione,1,6-dihydro-
| Molecular Formula | C5H4N4S |
|---|---|
| Molecular Weight | 152.02 g/mol |
| LogP | 1.01549 |
| Topological Polar Surface Area | 57.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 152.01567 |
| Heavy Atoms | 10 |
| Complexity | 400.9402 |
Chemical Identifiers
| CAS Number | 120614-05-3 |
|---|---|
| SMILES | C1=NNC2=C1NC=NC2=S |
Product Overview
1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione (CAS 120614-05-3), with molecular formula C5H4N4S and molecular weight 152.02 g/mol. IUPAC: 1,4-dihydropyrazolo[4,5-d]pyrimidine-7-thione.
Chemical Property Profile of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione
Property Insights of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione
The XLogP value of 1.01549 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione. With a topological polar surface area (TPSA) of 57.36 Ų, 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione 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 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione?
The CAS number of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione is 120614-05-3.
What is the molecular formula of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione?
The molecular formula of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione is C5H4N4S.
What is the molecular weight of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione?
The molecular weight of 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione is 152.02 g/mol.
Where can I buy 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione?
You can request a quote for 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dihydropyrazolo[4,5-d]pyrimidine-7-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.