![2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol structure](/static/products/3382/33822-98-9.webp)
2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol
TL;DR: 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol (CAS 33822-98-9) is a chemical compound with molecular formula C16H17ClN4O7 and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-diacetyloxy-5-(7-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate
Also Known As: 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol, [3,4-diacetyloxy-5-(7-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate, 2,3,5-Tri-O-acetyl-1,4-anhydro-1-(7-chloro-1H-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol, [3,4-diacetoxy-5-(7-chloro-1H-pyrazolo[4,3-d]pyrimidin-3-yl)tetrahydrofuran-2-yl]methyl acetate
| Molecular Formula | C16H17ClN4O7 |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.07858 |
| Heavy Atoms | 28 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 33822-98-9 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(O1)C2=C3C(=NN2)C(=NC=N3)Cl)OC(=O)C)OC(=O)C |
| InChIKey | UFBRJTPMMKAJHM-UHFFFAOYSA-N |
Product Overview
2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol (CAS 33822-98-9), with molecular formula C16H17ClN4O7 and molecular weight 412.08 g/mol. IUPAC: [3,4-diacetyloxy-5-(7-chloro-2H-pyrazolo[4,3-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate.
Chemical Property Profile of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol
Property Insights of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol. The TPSA of 143.0 Ų indicates high polarity, suggesting 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol has 1 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 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol?
The CAS number of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol is 33822-98-9.
What is the molecular formula of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol?
The molecular formula of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol is C16H17ClN4O7.
What is the molecular weight of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol?
The molecular weight of 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol is 412.08 g/mol.
Where can I buy 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol?
You can request a quote for 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5-tri-o-acetyl-1,4-anhydro-1-(7-chloro-2h-pyrazolo[4,3-d]pyrimidin-3-yl)pentitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.