3-Imino-6-phenylimino-cyclohexa-1,4-diene
TL;DR: 3-Imino-6-phenylimino-cyclohexa-1,4-diene (CAS 35548-96-0) is a chemical compound with molecular formula C12H10N2 and molecular weight 182.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-phenylcyclohexa-2,5-diene-1,4-diimine
Also Known As: N-phenyl-1,4-benzoquinonediimine, N-phenyl-1,4-benzoquinone diimine, N-Phenyl-p-benzoquinone diimine, 3-Imino-6-phenylimino-cyclohexa-1,4-diene, N-Phenyl-2,5-cyclohexadiene-1,4-diimine
| Molecular Formula | C12H10N2 |
|---|---|
| Molecular Weight | 182.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 36.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.0844 |
| Heavy Atoms | 14 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 35548-96-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=C2C=CC(=N)C=C2 |
| InChIKey | HZUDUMYMCSZNCX-UHFFFAOYSA-N |
Product Overview
3-Imino-6-phenylimino-cyclohexa-1,4-diene (CAS 35548-96-0), with molecular formula C12H10N2 and molecular weight 182.08 g/mol. IUPAC: 4-N-phenylcyclohexa-2,5-diene-1,4-diimine.
Chemical Property Profile of 3-Imino-6-phenylimino-cyclohexa-1,4-diene
Property Insights of 3-Imino-6-phenylimino-cyclohexa-1,4-diene
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Imino-6-phenylimino-cyclohexa-1,4-diene. With a topological polar surface area (TPSA) of 36.2 Ų, 3-Imino-6-phenylimino-cyclohexa-1,4-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Imino-6-phenylimino-cyclohexa-1,4-diene has 1 hydrogen bond donor(s) and 2 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 3-Imino-6-phenylimino-cyclohexa-1,4-diene?
The CAS number of 3-Imino-6-phenylimino-cyclohexa-1,4-diene is 35548-96-0.
What is the molecular formula of 3-Imino-6-phenylimino-cyclohexa-1,4-diene?
The molecular formula of 3-Imino-6-phenylimino-cyclohexa-1,4-diene is C12H10N2.
What is the molecular weight of 3-Imino-6-phenylimino-cyclohexa-1,4-diene?
The molecular weight of 3-Imino-6-phenylimino-cyclohexa-1,4-diene is 182.08 g/mol.
Where can I buy 3-Imino-6-phenylimino-cyclohexa-1,4-diene?
You can request a quote for 3-Imino-6-phenylimino-cyclohexa-1,4-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Imino-6-phenylimino-cyclohexa-1,4-diene?
Yes, KEHONG BIO provides custom synthesis services for 3-Imino-6-phenylimino-cyclohexa-1,4-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.