1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide
TL;DR: 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide (CAS 86071-41-2) is a chemical compound with molecular formula C8H9FN2O4S and molecular weight 248.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1-dioxothiolan-2-yl)-5-fluoropyrimidine-2,4-dione
Also Known As: FUSO2, 1-(1,1-dioxothiolan-2-yl)-5-fluoropyrimidine-2,4-dione, 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide, 2,4(1h,3h)-pyrimidinedione, 5-fluoro-1-(tetrahydro-1,1-dioxido-2-thienyl)-, 1-(1,1-dioxidotetrahydrothiophen-2-yl)-5-fluoropyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C8H9FN2O4S |
|---|---|
| Molecular Weight | 248.03 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.0267 |
| Heavy Atoms | 16 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 86071-41-2 |
|---|---|
| SMILES | C1CC(S(=O)(=O)C1)N2C=C(C(=O)NC2=O)F |
| InChIKey | YUPJZHWEUDXVQY-UHFFFAOYSA-N |
Product Overview
1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide (CAS 86071-41-2), with molecular formula C8H9FN2O4S and molecular weight 248.03 g/mol. IUPAC: 1-(1,1-dioxothiolan-2-yl)-5-fluoropyrimidine-2,4-dione.
Chemical Property Profile of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide
Property Insights of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide
The XLogP value of -0.7 indicates that 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide. Following Lipinski's Rule of Five, 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide has 1 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 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide?
The CAS number of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide is 86071-41-2.
What is the molecular formula of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide?
The molecular formula of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide is C8H9FN2O4S.
What is the molecular weight of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide?
The molecular weight of 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide is 248.03 g/mol.
Where can I buy 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide?
You can request a quote for 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2'-Tetrahydrothienyl)-5 fluorouracil-1-'1'-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.