5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺
TL;DR: 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 (CAS 61539-16-0) is a chemical compound with molecular formula C12H13ClN4O and molecular weight 264.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺
5-(4-chlorophenyl)-6-ethoxypyrimidine-2,4-diamine
Also Known As: 5-(4-chlorophenyl)-6-ethoxypyrimidine-2,4-diamine, 5-(4-chlorophenyl)-6-ethoxy-2,4-pyrimidinediamine, 5-(4-chloro-phenyl)-6-ethoxy-pyrimidine-2,4-diamine, RefChem:299897
| Molecular Formula | C12H13ClN4O |
|---|---|
| Molecular Weight | 264.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 87.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.0778 |
| Heavy Atoms | 18 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 61539-16-0 |
|---|---|
| SMILES | CCOC1=NC(=NC(=C1C2=CC=C(C=C2)Cl)N)N |
| InChIKey | YBRXIJRFDSXLHT-UHFFFAOYSA-N |
Product Overview
5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 (CAS 61539-16-0), with molecular formula C12H13ClN4O and molecular weight 264.08 g/mol. IUPAC: 5-(4-chlorophenyl)-6-ethoxypyrimidine-2,4-diamine.
Chemical Property Profile of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺
Property Insights of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺. Following Lipinski's Rule of Five, 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 has 2 hydrogen bond donor(s) and 5 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-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺?
The CAS number of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 is 61539-16-0.
What is the molecular formula of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺?
The molecular formula of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 is C12H13ClN4O.
What is the molecular weight of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺?
The molecular weight of 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 is 264.08 g/mol.
Where can I buy 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺?
You can request a quote for 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-氯苯基)-6-乙氧基嘧啶-2,4-二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.