1,3-Dimethyl-5-formyluracil
TL;DR: 1,3-Dimethyl-5-formyluracil (CAS 4869-46-9) is a chemical compound with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2,4-dioxopyrimidine-5-carbaldehyde
Also Known As: 1,3-Dimethyluracil-5-carboxaldehyde, 1,3-Dimethyl-5-formyluracil, 1,3-DiMe-5-FormU, 1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde, 5-formyl-1,3-dimethyluracil
| Molecular Formula | C7H8N2O3 |
|---|---|
| Molecular Weight | 168.05 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.0535 |
| Heavy Atoms | 12 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 4869-46-9 |
|---|---|
| SMILES | CN1C=C(C(=O)N(C1=O)C)C=O |
| InChIKey | KGJFRZOATIXYPW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dimethyl-5-formyluracil (CAS 4869-46-9), with molecular formula C7H8N2O3 and molecular weight 168.05 g/mol. IUPAC: 1,3-dimethyl-2,4-dioxopyrimidine-5-carbaldehyde.
Chemical Property Profile of 1,3-Dimethyl-5-formyluracil
Property Insights of 1,3-Dimethyl-5-formyluracil
The XLogP value of -0.9 indicates that 1,3-Dimethyl-5-formyluracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.7 Ų, 1,3-Dimethyl-5-formyluracil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethyl-5-formyluracil has 0 hydrogen bond donor(s) and 3 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 1,3-Dimethyl-5-formyluracil?
The CAS number of 1,3-Dimethyl-5-formyluracil is 4869-46-9.
What is the molecular formula of 1,3-Dimethyl-5-formyluracil?
The molecular formula of 1,3-Dimethyl-5-formyluracil is C7H8N2O3.
What is the molecular weight of 1,3-Dimethyl-5-formyluracil?
The molecular weight of 1,3-Dimethyl-5-formyluracil is 168.05 g/mol.
Where can I buy 1,3-Dimethyl-5-formyluracil?
You can request a quote for 1,3-Dimethyl-5-formyluracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl-5-formyluracil?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-5-formyluracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.