Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride
TL;DR: Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride (CAS 16667-82-6) is a chemical compound with molecular formula C9H14ClF2N3O2 and molecular weight 269.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[bis(2-fluoroethyl)amino]methyl]-1H-pyrimidine-2,4-dione;hydrochloride
Also Known As: 5-((Bis(2-fluoroethyl)amino)methyl)uracil monohydrochloride, Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride, 5-[[bis(2-fluoroethyl)amino]methyl]-1H-pyrimidine-2,4-dione hydrochloride, 5-{[Bis(2-fluoroethyl)amino]methyl}pyrimidine-2,4(1H,3H)-dione--hydrogen chloride (1/1), RefChem:387003
| Molecular Formula | C9H14ClF2N3O2 |
|---|---|
| Molecular Weight | 269.07 g/mol |
| LogP | 0.226 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.07425 |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 16667-82-6 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1)CN(CCF)CCF.Cl |
| InChIKey | MOAHKGNUWLNNBD-UHFFFAOYSA-N |
Product Overview
Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride (CAS 16667-82-6), with molecular formula C9H14ClF2N3O2 and molecular weight 269.07 g/mol. IUPAC: 5-[[bis(2-fluoroethyl)amino]methyl]-1H-pyrimidine-2,4-dione;hydrochloride.
Chemical Property Profile of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride
Property Insights of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride
The XLogP value of 0.226 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride. Following Lipinski's Rule of Five, Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride has 3 hydrogen bond donor(s) and 5 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 Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride?
The CAS number of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride is 16667-82-6.
What is the molecular formula of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride?
The molecular formula of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride is C9H14ClF2N3O2.
What is the molecular weight of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride?
The molecular weight of Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride is 269.07 g/mol.
Where can I buy Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride?
You can request a quote for Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Uracil, 5-((bis(2-fluoroethyl)amino)methyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.