![2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid structure](/static/products/1540/154094-87-8.webp)
2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid
TL;DR: 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid (CAS 154094-87-8) is a chemical compound with molecular formula C37H29N3O6S2 and molecular weight 675.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid
Also Known As: 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid, 2-{[(1e,4e)-4-([4-(phenylamino)phenyl]{4-[(2-sulfophenyl)amino]phenyl}methylidene)cyclohexa-2,5-dien-1-ylidene]amino}benzenesulfonic acid
| Molecular Formula | C37H29N3O6S2 |
|---|---|
| Molecular Weight | 675.15 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 675.1498 |
| Heavy Atoms | 48 |
| Complexity | 1400.0 |
Chemical Identifiers
| CAS Number | 154094-87-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4S(=O)(=O)O)C=C3)C5=CC=C(C=C5)NC6=CC=CC=C6S(=O)(=O)O |
| InChIKey | KDUQQIROQSSCFW-UHFFFAOYSA-N |
Product Overview
2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid (CAS 154094-87-8), with molecular formula C37H29N3O6S2 and molecular weight 675.15 g/mol. IUPAC: 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid.
Chemical Property Profile of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid
Property Insights of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid
The XLogP value of 7.6 indicates that 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.0 Ų indicates high polarity, suggesting 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid?
The CAS number of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid is 154094-87-8.
What is the molecular formula of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid?
The molecular formula of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid is C37H29N3O6S2.
What is the molecular weight of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid?
The molecular weight of 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid is 675.15 g/mol.
Where can I buy 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid?
You can request a quote for 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-[(4-anilinophenyl)-[4-(2-sulfophenyl)iminocyclohexa-2,5-dien-1-ylidene]methyl]anilino]benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.