4,6-Diamino-1-benzylpyrimidin-2-one
TL;DR: 4,6-Diamino-1-benzylpyrimidin-2-one (CAS 56540-96-6) is a chemical compound with molecular formula C11H12N4O and molecular weight 216.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-diamino-1-benzylpyrimidin-2-one
Also Known As: 4,6-diamino-1-benzylpyrimidin-2-one, 4,6-diamino-1-benzyl-1H-pyrimidin-2-one, 4,6-diamino-1-benzyl-pyrimidin-2-one, 4,6-Diamino-1-benzylpyrimidin-2(1h)-one
| Molecular Formula | C11H12N4O |
|---|---|
| Molecular Weight | 216.10 g/mol |
| LogP | 0.456 |
| Topological Polar Surface Area | 86.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.1011 |
| Heavy Atoms | 16 |
| Complexity | 547.6562 |
Chemical Identifiers
| CAS Number | 56540-96-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=CC(=NC2=O)N)N |
Product Overview
4,6-Diamino-1-benzylpyrimidin-2-one (CAS 56540-96-6), with molecular formula C11H12N4O and molecular weight 216.10 g/mol. IUPAC: 4,6-diamino-1-benzylpyrimidin-2-one.
Chemical Property Profile of 4,6-Diamino-1-benzylpyrimidin-2-one
Property Insights of 4,6-Diamino-1-benzylpyrimidin-2-one
The XLogP value of 0.456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Diamino-1-benzylpyrimidin-2-one. The TPSA of 86.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Diamino-1-benzylpyrimidin-2-one. Following Lipinski's Rule of Five, 4,6-Diamino-1-benzylpyrimidin-2-one 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 4,6-Diamino-1-benzylpyrimidin-2-one?
The CAS number of 4,6-Diamino-1-benzylpyrimidin-2-one is 56540-96-6.
What is the molecular formula of 4,6-Diamino-1-benzylpyrimidin-2-one?
The molecular formula of 4,6-Diamino-1-benzylpyrimidin-2-one is C11H12N4O.
What is the molecular weight of 4,6-Diamino-1-benzylpyrimidin-2-one?
The molecular weight of 4,6-Diamino-1-benzylpyrimidin-2-one is 216.10 g/mol.
Where can I buy 4,6-Diamino-1-benzylpyrimidin-2-one?
You can request a quote for 4,6-Diamino-1-benzylpyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Diamino-1-benzylpyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Diamino-1-benzylpyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.