![2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile structure](/static/products/314/314767-73-2.png)
2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile
TL;DR: 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile (CAS 314767-73-2) is a chemical compound with molecular formula C21H21N5 and molecular weight 343.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
Also Known As: 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile, 2-amino-4-(4-dimethylaminophenyl)-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile, 2-AMINO-4-[4-(DIMETHYLAMINO)PHENYL]-4A,5,6,7-TETRAHYDRO-4H-NAPHTHALENE-1,3,3-TRICARBONITRILE, 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
| Molecular Formula | C21H21N5 |
|---|---|
| Molecular Weight | 343.18 g/mol |
| LogP | 3.34624 |
| Topological Polar Surface Area | 100.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.1797 |
| Heavy Atoms | 26 |
| Complexity | 885.69543 |
Chemical Identifiers
| CAS Number | 314767-73-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2C3CCCC=C3C(=C(C2(C#N)C#N)N)C#N |
Product Overview
2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile (CAS 314767-73-2), with molecular formula C21H21N5 and molecular weight 343.18 g/mol. IUPAC: 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile.
Chemical Property Profile of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile
Property Insights of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile
The XLogP value of 3.34624 indicates that 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile. Following Lipinski's Rule of Five, 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile has 1 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 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile?
The CAS number of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile is 314767-73-2.
What is the molecular formula of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile?
The molecular formula of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile is C21H21N5.
What is the molecular weight of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile?
The molecular weight of 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile is 343.18 g/mol.
Where can I buy 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile?
You can request a quote for 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-4-[4-(dimethylamino)phenyl]-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.