5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione
TL;DR: 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione (CAS 171003-68-2) is a chemical compound with molecular formula C9H6BrN3O2 and molecular weight 266.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(6-bromo-2-pyridinyl)-1H-pyrimidine-2,4-dione
Also Known As: 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione, 5-(6-bromo-2-pyridinyl)-2,4(1H,3H)-pyrimidinedione, 5-(6-Bromopyridin-2-yl)pyrimidine-2,4(1H,3H)-dione, AI-942/42302057
| Molecular Formula | C9H6BrN3O2 |
|---|---|
| Molecular Weight | 266.96 g/mol |
| LogP | 0.8877 |
| Topological Polar Surface Area | 78.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.96432 |
| Heavy Atoms | 15 |
| Complexity | 602.5467 |
Chemical Identifiers
| CAS Number | 171003-68-2 |
|---|---|
| SMILES | C1=CC(=NC(=C1)Br)C2=CNC(=O)NC2=O |
Product Overview
5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione (CAS 171003-68-2), with molecular formula C9H6BrN3O2 and molecular weight 266.96 g/mol. IUPAC: 5-(6-bromo-2-pyridinyl)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione
Property Insights of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione
The XLogP value of 0.8877 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione. The TPSA of 78.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione 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-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione?
The CAS number of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione is 171003-68-2.
What is the molecular formula of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione?
The molecular formula of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione is C9H6BrN3O2.
What is the molecular weight of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione?
The molecular weight of 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione is 266.96 g/mol.
Where can I buy 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione?
You can request a quote for 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(6-bromopyridin-2-yl)-1H-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.