5-Bromo-1-ethyl-2(1H)-pyrimidinimine
TL;DR: 5-Bromo-1-ethyl-2(1H)-pyrimidinimine (CAS 4214-68-0) is a chemical compound with molecular formula CCN1C=C(C=NC1=N)Br and molecular weight 200.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-ethylpyrimidin-2-imine
Also Known As: 5-Bromo-1-ethyl-2(1H)-pyrimidinimine, 5-bromo-1-ethylpyrimidin-2-imine, 5-bromo-1-ethyl-pyrimidin-2-imine, 5-Bromo-1-ethylpyrimidin-2(1H)-imine, pyrimidine, 5-bromo-1-ethyl-1,2-dihydro-2-imino-
| Molecular Formula | CCN1C=C(C=NC1=N)Br |
|---|---|
| Molecular Weight | 200.99 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 39.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.99016 |
| Heavy Atoms | 10 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 4214-68-0 |
|---|---|
| SMILES | CCN1C=C(C=NC1=N)Br |
| InChIKey | DSEBWAGPFJIQIX-UHFFFAOYSA-N |
Product Overview
5-Bromo-1-ethyl-2(1H)-pyrimidinimine (CAS 4214-68-0), with molecular formula CCN1C=C(C=NC1=N)Br and molecular weight 200.99 g/mol. IUPAC: 5-bromo-1-ethylpyrimidin-2-imine.
Chemical Property Profile of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine
Property Insights of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-1-ethyl-2(1H)-pyrimidinimine. With a topological polar surface area (TPSA) of 39.5 Ų, 5-Bromo-1-ethyl-2(1H)-pyrimidinimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-1-ethyl-2(1H)-pyrimidinimine has 1 hydrogen bond donor(s) and 1 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-Bromo-1-ethyl-2(1H)-pyrimidinimine?
The CAS number of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine is 4214-68-0.
What is the molecular formula of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine?
The molecular formula of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine is CCN1C=C(C=NC1=N)Br.
What is the molecular weight of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine?
The molecular weight of 5-Bromo-1-ethyl-2(1H)-pyrimidinimine is 200.99 g/mol.
Where can I buy 5-Bromo-1-ethyl-2(1H)-pyrimidinimine?
You can request a quote for 5-Bromo-1-ethyl-2(1H)-pyrimidinimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-1-ethyl-2(1H)-pyrimidinimine?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-1-ethyl-2(1H)-pyrimidinimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.