Etoprine
TL;DR: Etoprine (CAS 18588-57-3) is a chemical compound with molecular formula C12H12Cl2N4 and molecular weight 282.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dichlorophenyl)-6-ethylpyrimidine-2,4-diamine
Also Known As: ETOPRINE, Ethodichlorophen, Etoprine [USAN], DDEP, Etoprine (USAN)
| Molecular Formula | C12H12Cl2N4 |
|---|---|
| Molecular Weight | 282.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.0439 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 18588-57-3 |
|---|---|
| SMILES | CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)Cl |
| InChIKey | PXLPCZJACKUXGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Etoprine (CAS 18588-57-3), with molecular formula C12H12Cl2N4 and molecular weight 282.04 g/mol. IUPAC: 5-(3,4-dichlorophenyl)-6-ethylpyrimidine-2,4-diamine.
Chemical Property Profile of Etoprine
Property Insights of Etoprine
The XLogP value of 3.1 indicates that Etoprine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Etoprine. Following Lipinski's Rule of Five, Etoprine has 2 hydrogen bond donor(s) and 4 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 Etoprine?
The CAS number of Etoprine is 18588-57-3.
What is the molecular formula of Etoprine?
The molecular formula of Etoprine is C12H12Cl2N4.
What is the molecular weight of Etoprine?
The molecular weight of Etoprine is 282.04 g/mol.
Where can I buy Etoprine?
You can request a quote for Etoprine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Etoprine?
Yes, KEHONG BIO provides custom synthesis services for Etoprine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.