Vaneprim
TL;DR: Vaneprim (CAS 84854-86-4) is a chemical compound with molecular formula C23H28N4O8S and molecular weight 520.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]amino]-(3-ethoxy-4-hydroxyphenyl)methanesulfonic acid
Also Known As: Vaneprim, Vaneprimum, vaneprima, vaneprime, Vaneprim [INN]
| Molecular Formula | C23H28N4O8S |
|---|---|
| Molecular Weight | 520.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 520.1628 |
| Heavy Atoms | 36 |
| Complexity | 758.0 |
Chemical Identifiers
| CAS Number | 84854-86-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C(NC2=NC=C(C(=N2)N)CC3=CC(=C(C(=C3)OC)OC)OC)S(=O)(=O)O)O |
| InChIKey | HCHKZQYFQOONNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vaneprim (CAS 84854-86-4), with molecular formula C23H28N4O8S and molecular weight 520.16 g/mol. IUPAC: [[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]amino]-(3-ethoxy-4-hydroxyphenyl)methanesulfonic acid.
Chemical Property Profile of Vaneprim
Property Insights of Vaneprim
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vaneprim. The TPSA of 184.0 Ų indicates high polarity, suggesting Vaneprim may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vaneprim has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Vaneprim?
The CAS number of Vaneprim is 84854-86-4.
What is the molecular formula of Vaneprim?
The molecular formula of Vaneprim is C23H28N4O8S.
What is the molecular weight of Vaneprim?
The molecular weight of Vaneprim is 520.16 g/mol.
Where can I buy Vaneprim?
You can request a quote for Vaneprim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vaneprim?
Yes, KEHONG BIO provides custom synthesis services for Vaneprim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.