5-Benzyluracil
TL;DR: 5-Benzyluracil (CAS 21381-33-9) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-1H-pyrimidine-2,4-dione
Also Known As: 5-Benzyluracil, 5-Benzyl-1H-pyrimidine-2,4-dione, 5-benzylpyrimidine-2,4(1H,3H)-dione, 5-Benzyl-1,2,3,4-tetrahydropyrimidine-2,4-dione, 5-(phenylmethyl)pyrimidine-2,4-diol
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 21381-33-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CNC(=O)NC2=O |
| InChIKey | RPZOVLGFKOOIRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Benzyluracil (CAS 21381-33-9), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 5-benzyl-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-Benzyluracil
Property Insights of 5-Benzyluracil
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzyluracil. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Benzyluracil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzyluracil has 2 hydrogen bond donor(s) and 2 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-Benzyluracil?
The CAS number of 5-Benzyluracil is 21381-33-9.
What is the molecular formula of 5-Benzyluracil?
The molecular formula of 5-Benzyluracil is C11H10N2O2.
What is the molecular weight of 5-Benzyluracil?
The molecular weight of 5-Benzyluracil is 202.07 g/mol.
Where can I buy 5-Benzyluracil?
You can request a quote for 5-Benzyluracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzyluracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzyluracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.