N,N-Dimethylthymine
TL;DR: N,N-Dimethylthymine (CAS 4401-71-2) is a chemical compound with molecular formula C7H10N2O2 and molecular weight 154.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trimethylpyrimidine-2,4-dione
Also Known As: 1,3-Dimethylthymine, 1,3,5-trimethylpyrimidine-2,4(1H,3H)-dione, N,N-Dimethylthymine, 1,3,5-trimethylpyrimidine-2,4-dione, 1,3,5-trimethyluracil
| Molecular Formula | C7H10N2O2 |
|---|---|
| Molecular Weight | 154.07 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.07423 |
| Heavy Atoms | 11 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 4401-71-2 |
|---|---|
| SMILES | CC1=CN(C(=O)N(C1=O)C)C |
| InChIKey | BHWQEVXICGSHEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-Dimethylthymine (CAS 4401-71-2), with molecular formula C7H10N2O2 and molecular weight 154.07 g/mol. IUPAC: 1,3,5-trimethylpyrimidine-2,4-dione.
Chemical Property Profile of N,N-Dimethylthymine
Property Insights of N,N-Dimethylthymine
The XLogP value of -0.2 indicates that N,N-Dimethylthymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.6 Ų, N,N-Dimethylthymine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Dimethylthymine has 0 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 N,N-Dimethylthymine?
The CAS number of N,N-Dimethylthymine is 4401-71-2.
What is the molecular formula of N,N-Dimethylthymine?
The molecular formula of N,N-Dimethylthymine is C7H10N2O2.
What is the molecular weight of N,N-Dimethylthymine?
The molecular weight of N,N-Dimethylthymine is 154.07 g/mol.
Where can I buy N,N-Dimethylthymine?
You can request a quote for N,N-Dimethylthymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethylthymine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethylthymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.