3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione
TL;DR: 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione (CAS 4160-77-4) is a chemical compound with molecular formula C6H8N2O2 and molecular weight 140.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1H-pyrimidine-2,4-dione
Also Known As: 3-Methylthymine, 3,5-dimethyluracil, N3-methylthymine, 3-methyl-thymine, 5-Methyl-3-methyluracil
| Molecular Formula | C6H8N2O2 |
|---|---|
| Molecular Weight | 140.06 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.05858 |
| Heavy Atoms | 10 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 4160-77-4 |
|---|---|
| SMILES | CC1=CNC(=O)N(C1=O)C |
| InChIKey | IIDONYMEGWHGRU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione (CAS 4160-77-4), with molecular formula C6H8N2O2 and molecular weight 140.06 g/mol. IUPAC: 3,5-dimethyl-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione
Property Insights of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione
The XLogP value of -0.4 indicates that 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.4 Ų, 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione has 1 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 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione?
The CAS number of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione is 4160-77-4.
What is the molecular formula of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione?
The molecular formula of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione is C6H8N2O2.
What is the molecular weight of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione?
The molecular weight of 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione is 140.06 g/mol.
Where can I buy 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione?
You can request a quote for 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-2,4(1H,3H)-pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.