5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine
TL;DR: 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine (CAS 71125-75-2) is a chemical compound with molecular formula C17H19N5O2 and molecular weight 325.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,5-dimethoxy-4-pyrrol-1-ylphenyl)methyl]pyrimidine-2,4-diamine
Also Known As: Pyrimidine analog, J1.608.159K, 24NH2PYRIMIDIN,5(35MEO-4(1PYRRYL))BENZYL, 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine, 2,4-Diamino-5-(3,5-dimethoxy-4-N-pyrrolbenzyl)pyrimidine
| Molecular Formula | C17H19N5O2 |
|---|---|
| Molecular Weight | 325.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.15387 |
| Heavy Atoms | 24 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 71125-75-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1N2C=CC=C2)OC)CC3=CN=C(N=C3N)N |
| InChIKey | UKZISKAMNXJJKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine (CAS 71125-75-2), with molecular formula C17H19N5O2 and molecular weight 325.15 g/mol. IUPAC: 5-[(3,5-dimethoxy-4-pyrrol-1-ylphenyl)methyl]pyrimidine-2,4-diamine.
Chemical Property Profile of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine
Property Insights of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine has 2 hydrogen bond donor(s) and 6 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 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine?
The CAS number of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine is 71125-75-2.
What is the molecular formula of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine?
The molecular formula of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine is C17H19N5O2.
What is the molecular weight of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine?
The molecular weight of 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine is 325.15 g/mol.
Where can I buy 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine?
You can request a quote for 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,5-Dimethoxy-4-pyrrol-1-yl-benzyl)-pyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.