4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide
TL;DR: 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide (CAS 18520-94-0) is a chemical compound with molecular formula C20H23N5O9 and molecular weight 477.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4-acetamido-5-carbamoylpyrrolo[2,3-d]pyrimidin-7-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate
Also Known As: 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide, 7H-Pyrrolo[2, 4-(acetylamino)-7-.beta.-D-ribofuranosyl-, 2',3',5'-triacetate, 7H-Pyrrolo[2, 4-acetamido-7-.beta.-D-ribofuranosyl-, 2',3',5'-triacetate, [5-(4-acetamido-5-carbamoylpyrrolo[2,3-d]pyrimidin-7-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate, 4-Acetamido-7-(2,3,5-tri-O-acetylpentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide
| Molecular Formula | C20H23N5O9 |
|---|---|
| Molecular Weight | 477.15 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 477.14957 |
| Heavy Atoms | 34 |
| Complexity | 839.0 |
Chemical Identifiers
| CAS Number | 18520-94-0 |
|---|---|
| SMILES | CC(=O)NC1=C2C(=CN(C2=NC=N1)C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)C(=O)N |
| InChIKey | JHJRENZMYFNCTB-UHFFFAOYSA-N |
Product Overview
4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide (CAS 18520-94-0), with molecular formula C20H23N5O9 and molecular weight 477.15 g/mol. IUPAC: [5-(4-acetamido-5-carbamoylpyrrolo[2,3-d]pyrimidin-7-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate.
Chemical Property Profile of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide
Property Insights of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide
The XLogP value of -1.4 indicates that 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide?
The CAS number of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide is 18520-94-0.
What is the molecular formula of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide?
The molecular formula of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide is C20H23N5O9.
What is the molecular weight of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide?
The molecular weight of 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide is 477.15 g/mol.
Where can I buy 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide?
You can request a quote for 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(acetylamino)-7-(2,3,5-tri-o-acetylpentofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.