2,4-Bis(benzyloxy)-5-bromopyrimidine
TL;DR: 2,4-Bis(benzyloxy)-5-bromopyrimidine (CAS 41244-53-5) is a chemical compound with molecular formula C18H15BrN2O2 and molecular weight 370.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2,4-bis(phenylmethoxy)pyrimidine
Also Known As: 2,4-bis(benzyloxy)-5-bromopyrimidine, Carbimazole, 5-Bromo-2,4-di(benzyloxy)pyrimidine, 5-bromo-2,4-bis(phenylmethoxy)pyrimidine, NCIOpen2_008965
| Molecular Formula | C18H15BrN2O2 |
|---|---|
| Molecular Weight | 370.03 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 44.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.03168 |
| Heavy Atoms | 23 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 41244-53-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=NC(=NC=C2Br)OCC3=CC=CC=C3 |
| InChIKey | QMPWETJGPVPWGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Bis(benzyloxy)-5-bromopyrimidine (CAS 41244-53-5), with molecular formula C18H15BrN2O2 and molecular weight 370.03 g/mol. IUPAC: 5-bromo-2,4-bis(phenylmethoxy)pyrimidine.
Chemical Property Profile of 2,4-Bis(benzyloxy)-5-bromopyrimidine
Property Insights of 2,4-Bis(benzyloxy)-5-bromopyrimidine
The XLogP value of 4.5 indicates that 2,4-Bis(benzyloxy)-5-bromopyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.2 Ų, 2,4-Bis(benzyloxy)-5-bromopyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Bis(benzyloxy)-5-bromopyrimidine has 0 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 2,4-Bis(benzyloxy)-5-bromopyrimidine?
The CAS number of 2,4-Bis(benzyloxy)-5-bromopyrimidine is 41244-53-5.
What is the molecular formula of 2,4-Bis(benzyloxy)-5-bromopyrimidine?
The molecular formula of 2,4-Bis(benzyloxy)-5-bromopyrimidine is C18H15BrN2O2.
What is the molecular weight of 2,4-Bis(benzyloxy)-5-bromopyrimidine?
The molecular weight of 2,4-Bis(benzyloxy)-5-bromopyrimidine is 370.03 g/mol.
Where can I buy 2,4-Bis(benzyloxy)-5-bromopyrimidine?
You can request a quote for 2,4-Bis(benzyloxy)-5-bromopyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Bis(benzyloxy)-5-bromopyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Bis(benzyloxy)-5-bromopyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.