2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile
TL;DR: 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile (CAS 1508-06-1) is a chemical compound with molecular formula C22H16N4 and molecular weight 336.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile
Also Known As: 2-imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile, 3-Cyclohexene-1,1,3-tricarbonitrile, 2-imino-6-methyl-4,6-diphenyl-, 1-imino-5-methyl-3,5-diphenyl-2-cyclohexene-2,6,6-tricarbonitrile, 2-imino-6-methyl-4,6-diphenyl-3-cyclohexene-1,1,3-tricarbonitrile, 3-Cyclohexene-1,1,3-tricarbonitrile,2-imino-6-methyl-4,6-diphenyl
| Molecular Formula | C22H16N4 |
|---|---|
| Molecular Weight | 336.14 g/mol |
| LogP | 4.37871 |
| Topological Polar Surface Area | 95.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.13748 |
| Heavy Atoms | 26 |
| Complexity | 999.7973 |
Chemical Identifiers
| CAS Number | 1508-06-1 |
|---|---|
| SMILES | CC1(CC(=C(C(=N)C1(C#N)C#N)C#N)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile (CAS 1508-06-1), with molecular formula C22H16N4 and molecular weight 336.14 g/mol. IUPAC: 2-imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile.
Chemical Property Profile of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile
Property Insights of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile
The XLogP value of 4.37871 indicates that 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile. Following Lipinski's Rule of Five, 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile has 1 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-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile?
The CAS number of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile is 1508-06-1.
What is the molecular formula of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile?
The molecular formula of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile is C22H16N4.
What is the molecular weight of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile?
The molecular weight of 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile is 336.14 g/mol.
Where can I buy 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile?
You can request a quote for 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Imino-6-methyl-4,6-diphenylcyclohex-3-ene-1,1,3-tricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.