![4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile structure](/static/products/4000/400084-06-2.webp)
4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile
TL;DR: 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile (CAS 400084-06-2) is a chemical compound with molecular formula C14H14N4O2 and molecular weight 270.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(dimethylamino)-5-methoxypyrimidin-4-yl]oxybenzonitrile
Also Known As: 5J-408S, 4-[2-(dimethylamino)-5-methoxypyrimidin-4-yl]oxybenzonitrile, 4-{[2-(dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile, 4-{[2-(dimethylamino)-5-methoxypyrimidin-4-yl]oxy}benzonitrile
| Molecular Formula | C14H14N4O2 |
|---|---|
| Molecular Weight | 270.11 g/mol |
| LogP | 2.21518 |
| Topological Polar Surface Area | 71.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.11166 |
| Heavy Atoms | 20 |
| Complexity | 632.6124 |
Chemical Identifiers
| CAS Number | 400084-06-2 |
|---|---|
| SMILES | CN(C)C1=NC=C(C(=N1)OC2=CC=C(C=C2)C#N)OC |
Product Overview
4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile (CAS 400084-06-2), with molecular formula C14H14N4O2 and molecular weight 270.11 g/mol. IUPAC: 4-[2-(dimethylamino)-5-methoxypyrimidin-4-yl]oxybenzonitrile.
Chemical Property Profile of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile
Property Insights of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile
The XLogP value of 2.21518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile. The TPSA of 71.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile. Following Lipinski's Rule of Five, 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile has 0 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 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile?
The CAS number of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile is 400084-06-2.
What is the molecular formula of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile?
The molecular formula of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile is C14H14N4O2.
What is the molecular weight of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile?
The molecular weight of 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile is 270.11 g/mol.
Where can I buy 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile?
You can request a quote for 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-{[2-(Dimethylamino)-5-methoxy-4-pyrimidinyl]oxy}benzenecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.