2,4-Diamino-5-benzylpyrimidine
TL;DR: 2,4-Diamino-5-benzylpyrimidine (CAS 7319-45-1) is a chemical compound with molecular formula C11H12N4 and molecular weight 200.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzylpyrimidine-2,4-diamine
Also Known As: 5-Benzyl-2,4-diaminopyrimidine, 5-benzylpyrimidine-2,4-diamine, 2,4-Diamino-5-benzylpyrimidine, 5-Benzyl-2,4-pyrimidinediamine, 5-Benzyl-pyrimidine-2,4-diamine
| Molecular Formula | C11H12N4 |
|---|---|
| Molecular Weight | 200.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.1062 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 7319-45-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CN=C(N=C2N)N |
| InChIKey | XHPZVBGIPQQTQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Diamino-5-benzylpyrimidine (CAS 7319-45-1), with molecular formula C11H12N4 and molecular weight 200.11 g/mol. IUPAC: 5-benzylpyrimidine-2,4-diamine.
Chemical Property Profile of 2,4-Diamino-5-benzylpyrimidine
Property Insights of 2,4-Diamino-5-benzylpyrimidine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diamino-5-benzylpyrimidine. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diamino-5-benzylpyrimidine. Following Lipinski's Rule of Five, 2,4-Diamino-5-benzylpyrimidine 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 2,4-Diamino-5-benzylpyrimidine?
The CAS number of 2,4-Diamino-5-benzylpyrimidine is 7319-45-1.
What is the molecular formula of 2,4-Diamino-5-benzylpyrimidine?
The molecular formula of 2,4-Diamino-5-benzylpyrimidine is C11H12N4.
What is the molecular weight of 2,4-Diamino-5-benzylpyrimidine?
The molecular weight of 2,4-Diamino-5-benzylpyrimidine is 200.11 g/mol.
Where can I buy 2,4-Diamino-5-benzylpyrimidine?
You can request a quote for 2,4-Diamino-5-benzylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diamino-5-benzylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diamino-5-benzylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.