2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol
TL;DR: 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol (CAS 42902-13-6) is a chemical compound with molecular formula C12H13N5O3 and molecular weight 275.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol
Also Known As: 2-(2,4-diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol
| Molecular Formula | C12H13N5O3 |
|---|---|
| Molecular Weight | 275.10 g/mol |
| LogP | 1.4842 |
| Topological Polar Surface Area | 141.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.10184 |
| Heavy Atoms | 20 |
| Complexity | 687.03326 |
Chemical Identifiers
| CAS Number | 42902-13-6 |
|---|---|
| SMILES | CCC1=C(C(=NC(=N1)N)N)C2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol (CAS 42902-13-6), with molecular formula C12H13N5O3 and molecular weight 275.10 g/mol. IUPAC: 2-(2,4-diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol.
Chemical Property Profile of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol
Property Insights of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol
The XLogP value of 1.4842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol. The TPSA of 141.19 Ų indicates high polarity, suggesting 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol has 3 hydrogen bond donor(s) and 7 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-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol?
The CAS number of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol is 42902-13-6.
What is the molecular formula of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol?
The molecular formula of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol is C12H13N5O3.
What is the molecular weight of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol?
The molecular weight of 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol is 275.10 g/mol.
Where can I buy 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol?
You can request a quote for 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.