2',3'-Isopropylidene-5'-tosylate
TL;DR: 2',3'-Isopropylidene-5'-tosylate (CAS 7354-93-0) is a chemical compound with molecular formula C19H22N2O8S and molecular weight 438.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2,4-dioxopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate
Also Known As: 2',3'-isopropylidene-5'-tosylate, BAS 00380082, 1-{2,3-o-(1-methylethylidene)-5-o-[(4-methylphenyl)sulfonyl]pentofuranosyl}pyrimidine-2,4(1h,3h)-dione, [4-(2,4-dioxo(1,3-dihydropyrimidinyl))-7,7-dimethyl-3,6,8-trioxabicyclo[3.3.0] oct-2-yl]methyl 4-methylbenzenesulfonate, [4-(2,4-dioxopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate
| Molecular Formula | C19H22N2O8S |
|---|---|
| Molecular Weight | 438.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.10968 |
| Heavy Atoms | 30 |
| Complexity | 828.0 |
Chemical Identifiers
| CAS Number | 7354-93-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC2C3C(C(O2)N4C=CC(=O)NC4=O)OC(O3)(C)C |
| InChIKey | DJTYEGXHECVJDF-UHFFFAOYSA-N |
Product Overview
2',3'-Isopropylidene-5'-tosylate (CAS 7354-93-0), with molecular formula C19H22N2O8S and molecular weight 438.11 g/mol. IUPAC: [4-(2,4-dioxopyrimidin-1-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-methylbenzenesulfonate.
Chemical Property Profile of 2',3'-Isopropylidene-5'-tosylate
Property Insights of 2',3'-Isopropylidene-5'-tosylate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',3'-Isopropylidene-5'-tosylate. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2',3'-Isopropylidene-5'-tosylate. Following Lipinski's Rule of Five, 2',3'-Isopropylidene-5'-tosylate has 1 hydrogen bond donor(s) and 8 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 2',3'-Isopropylidene-5'-tosylate?
The CAS number of 2',3'-Isopropylidene-5'-tosylate is 7354-93-0.
What is the molecular formula of 2',3'-Isopropylidene-5'-tosylate?
The molecular formula of 2',3'-Isopropylidene-5'-tosylate is C19H22N2O8S.
What is the molecular weight of 2',3'-Isopropylidene-5'-tosylate?
The molecular weight of 2',3'-Isopropylidene-5'-tosylate is 438.11 g/mol.
Where can I buy 2',3'-Isopropylidene-5'-tosylate?
You can request a quote for 2',3'-Isopropylidene-5'-tosylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',3'-Isopropylidene-5'-tosylate?
Yes, KEHONG BIO provides custom synthesis services for 2',3'-Isopropylidene-5'-tosylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.