![Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- structure](/static/products/1129/112900-27-3.webp)
Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-
TL;DR: Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- (CAS 112900-27-3) is a chemical compound with molecular formula C16H15N3 and molecular weight 249.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(dimethylamino)phenyl]methylideneamino]benzonitrile
Also Known As: BAS 00165599, Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-, 2-[[4-(dimethylamino)phenyl]methylideneamino]benzonitrile, 2-[(4-Dimethylamino-benzylidene)-amino]-benzonitrile, 2-[(4-dimethylaminophenyl)methylideneamino]benzonitrile
| Molecular Formula | C16H15N3 |
|---|---|
| Molecular Weight | 249.13 g/mol |
| LogP | 3.37488 |
| Topological Polar Surface Area | 39.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.1266 |
| Heavy Atoms | 19 |
| Complexity | 619.18744 |
Chemical Identifiers
| CAS Number | 112900-27-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C=NC2=CC=CC=C2C#N |
Product Overview
Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- (CAS 112900-27-3), with molecular formula C16H15N3 and molecular weight 249.13 g/mol. IUPAC: 2-[[4-(dimethylamino)phenyl]methylideneamino]benzonitrile.
Chemical Property Profile of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-
Property Insights of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-
The XLogP value of 3.37488 indicates that Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.39 Ų, Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- has 0 hydrogen bond donor(s) and 3 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 Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-?
The CAS number of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- is 112900-27-3.
What is the molecular formula of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-?
The molecular formula of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- is C16H15N3.
What is the molecular weight of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-?
The molecular weight of Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- is 249.13 g/mol.
Where can I buy Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-?
You can request a quote for Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzonitrile, 2-[[[4-(dimethylamino)phenyl]methylene]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.