TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl
TL;DR: TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl (CAS 67522-32-1) is a chemical compound with molecular formula C18H20F3N3O10 and molecular weight 495.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-diacetyloxy-6-(2,4-dioxopyrimidin-1-yl)-5-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]methyl acetate
Also Known As: TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl, 1-{3,4,6-tri-o-acetyl-2-deoxy-2-[(trifluoroacetyl)amino]hexopyranosyl}pyrimidine-2,4(1h,3h)-dione, [3,4-diacetyloxy-6-(2,4-dioxopyrimidin-1-yl)-5-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]methyl acetate, 4-Hydroxy-1-{3,4,6-tri-O-acetyl-2-deoxy-2-[(2,2,2-trifluoro-1-hydroxyethylidene)amino]hexopyranosyl}pyrimidin-2(1H)-one
| Molecular Formula | C18H20F3N3O10 |
|---|---|
| Molecular Weight | 495.11 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 9 |
| Exact Mass | 495.11008 |
| Heavy Atoms | 34 |
| Complexity | 906.0 |
Chemical Identifiers
| CAS Number | 67522-32-1 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)N2C=CC(=O)NC2=O)NC(=O)C(F)(F)F)OC(=O)C)OC(=O)C |
| InChIKey | MTAPNTGRYQXDAC-UHFFFAOYSA-N |
Product Overview
TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl (CAS 67522-32-1), with molecular formula C18H20F3N3O10 and molecular weight 495.11 g/mol. IUPAC: [3,4-diacetyloxy-6-(2,4-dioxopyrimidin-1-yl)-5-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]methyl acetate.
Chemical Property Profile of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl
Property Insights of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl
The XLogP value of -0.6 indicates that TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.0 Ų indicates high polarity, suggesting TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl?
The CAS number of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl is 67522-32-1.
What is the molecular formula of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl?
The molecular formula of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl is C18H20F3N3O10.
What is the molecular weight of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl?
The molecular weight of TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl is 495.11 g/mol.
Where can I buy TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl?
You can request a quote for TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl?
Yes, KEHONG BIO provides custom synthesis services for TfaNH(-2d)Hex3Ac4Ac6Ac-uracil-1-yl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.