2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile
TL;DR: 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile (CAS 303997-53-7) is a chemical compound with molecular formula C14H14N4 and molecular weight 238.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(dimethylamino)pyridazin-3-yl]-2-phenylacetonitrile
Also Known As: 2-[6-(dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile, 2-[6-(dimethylamino)pyridazin-3-yl]-2-phenylacetonitrile, [6-(Dimethylamino)-3-pyridazinyl](phenyl)acetonitrile, [6-(Dimethylamino)pyridazin-3-yl](phenyl)acetonitrile, 6-(Dimethylamino)-I+/--phenyl-3-pyridazineacetonitrile
| Molecular Formula | C14H14N4 |
|---|---|
| Molecular Weight | 238.12 g/mol |
| LogP | 2.19808 |
| Topological Polar Surface Area | 52.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.12184 |
| Heavy Atoms | 18 |
| Complexity | 540.2567 |
Chemical Identifiers
| CAS Number | 303997-53-7 |
|---|---|
| SMILES | CN(C)C1=NN=C(C=C1)C(C#N)C2=CC=CC=C2 |
Product Overview
2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile (CAS 303997-53-7), with molecular formula C14H14N4 and molecular weight 238.12 g/mol. IUPAC: 2-[6-(dimethylamino)pyridazin-3-yl]-2-phenylacetonitrile.
Chemical Property Profile of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile
Property Insights of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile
The XLogP value of 2.19808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile. With a topological polar surface area (TPSA) of 52.81 Ų, 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile has 0 hydrogen bond donor(s) and 4 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-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile?
The CAS number of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile is 303997-53-7.
What is the molecular formula of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile?
The molecular formula of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile is C14H14N4.
What is the molecular weight of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile?
The molecular weight of 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile is 238.12 g/mol.
Where can I buy 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile?
You can request a quote for 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[6-(Dimethylamino)-3-pyridazinyl]-2-phenylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.