![[4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol structure](/static/products/5345/53458-42-7.webp)
[4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol
TL;DR: [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol (CAS 53458-42-7) is a chemical compound with molecular formula C17H18N6O5 and molecular weight 386.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol
Also Known As: [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol|3-{2,3-O-[(4-Methoxyphenyl)methylidene]pentofuranosyl}-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine|3H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-7-AMINE,3-[2,3-O-[(4-METHOXYPHENYL)METHYLENE]-B-D-RIBOFURANOSYL]-
| Molecular Formula | C17H18N6O5 |
|---|---|
| Molecular Weight | 386.13 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.13388 |
| Heavy Atoms | 28 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 53458-42-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2OC3C(OC(C3O2)N4C5=NC=NC(=C5N=N4)N)CO |
| InChIKey | LBKUIAAZYSRVJP-UHFFFAOYSA-N |
Product Overview
[4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol (CAS 53458-42-7), with molecular formula C17H18N6O5 and molecular weight 386.13 g/mol. IUPAC: [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol.
Chemical Property Profile of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol
Property Insights of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol
The XLogP value of -0.3 indicates that [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol has 2 hydrogen bond donor(s) and 10 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 [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol?
The CAS number of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol is 53458-42-7.
What is the molecular formula of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol?
The molecular formula of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol is C17H18N6O5.
What is the molecular weight of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol?
The molecular weight of [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol is 386.13 g/mol.
Where can I buy [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol?
You can request a quote for [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol?
Yes, KEHONG BIO provides custom synthesis services for [4-(7-aminotriazolo[4,5-d]pyrimidin-3-yl)-2-(4-methoxyphenyl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.