5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide
TL;DR: 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide (CAS 4356-35-8) is a chemical compound with molecular formula CCN1C=C(C=NC1=N)Br.I and molecular weight 328.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-ethylpyrimidin-2-imine;hydroiodide
Also Known As: KST-1A4838, 5-bromo-1-ethylpyrimidin-2-imine hydroiodide, (2z)-5-bromo-1-ethylpyrimidin-2(1h)-imine hydroiodide(1:1), 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide, 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide
| Molecular Formula | CCN1C=C(C=NC1=N)Br.I |
|---|---|
| Molecular Weight | 328.90 g/mol |
| LogP | 1.76297 |
| Topological Polar Surface Area | 39.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.90247 |
| Heavy Atoms | 11 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 4356-35-8 |
|---|---|
| SMILES | CCN1C=C(C=NC1=N)Br.I |
| InChIKey | RIKLLHKFKUPHIF-UHFFFAOYSA-N |
Product Overview
5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide (CAS 4356-35-8), with molecular formula CCN1C=C(C=NC1=N)Br.I and molecular weight 328.90 g/mol. IUPAC: 5-bromo-1-ethylpyrimidin-2-imine;hydroiodide.
Chemical Property Profile of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide
Property Insights of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide
The XLogP value of 1.76297 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide. With a topological polar surface area (TPSA) of 39.5 Ų, 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide has 2 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-1,2-dihydro-2-iminopyrimidine monohydriodide?
The CAS number of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide is 4356-35-8.
What is the molecular formula of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide?
The molecular formula of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide is CCN1C=C(C=NC1=N)Br.I.
What is the molecular weight of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide?
The molecular weight of 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide is 328.90 g/mol.
Where can I buy 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide?
You can request a quote for 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide 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-1,2-dihydro-2-iminopyrimidine monohydriodide?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-1-ethyl-1,2-dihydro-2-iminopyrimidine monohydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.