6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine
TL;DR: 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine (CAS 339016-02-3) is a chemical compound with molecular formula C12H13ClN4O2 and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-N-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine
Also Known As: 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine, 6-chloro-N~4~-(3,4-dimethoxyphenyl)-2,4-pyrimidinediamine, 6-chloro-4-N-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine, 6-Chloro-N4-(3,4-dimethoxyphenyl)-2,4-pyrimidinediamine, 6-Chloro-N~4~-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine
| Molecular Formula | C12H13ClN4O2 |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 2.473 |
| Topological Polar Surface Area | 82.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.0727 |
| Heavy Atoms | 19 |
| Complexity | 571.6872 |
Chemical Identifiers
| CAS Number | 339016-02-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC2=CC(=NC(=N2)N)Cl)OC |
Product Overview
6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine (CAS 339016-02-3), with molecular formula C12H13ClN4O2 and molecular weight 280.07 g/mol. IUPAC: 6-chloro-4-N-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine.
Chemical Property Profile of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine
Property Insights of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine
The XLogP value of 2.473 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine. The TPSA of 82.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-Chloro-N4-(3,4-dimethoxyphenyl)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 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine?
The CAS number of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine is 339016-02-3.
What is the molecular formula of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine?
The molecular formula of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine is C12H13ClN4O2.
What is the molecular weight of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine?
The molecular weight of 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine is 280.07 g/mol.
Where can I buy 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine?
You can request a quote for 6-Chloro-N4-(3,4-dimethoxyphenyl)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 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-N4-(3,4-dimethoxyphenyl)pyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.