Pararosaniline, N-sulfophenyl-
TL;DR: Pararosaniline, N-sulfophenyl- (CAS 68966-37-0) is a chemical compound with molecular formula C25H21N3O3S and molecular weight 443.13037 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[4-[bis(4-aminophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonic acid
Also Known As: Pararosaniline, N-sulfophenyl-, 4-({4-[bis(4-aminophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene}amino)benzenesulfonic acid, ((4-((4-Aminophenyl)(4-iminocyclohexa-2,5-dien-1-ylidene)methyl)phenyl)amino)benzenesulphonic acid, 4-[[4-[bis(4-aminophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonic acid, Benzenesulfonic acid, ((4-((4-aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidene)methyl)phenyl)amino)-
Technical Specifications
| Molecular Formula | C25H21N3O3S |
| Molecular Weight | 443.13037 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.13037 Da |
| Heavy Atoms | 32 |
| Complexity | 834.0 |
| SMILES | C1=CC(=NC2=CC=C(C=C2)S(=O)(=O)O)C=CC1=C(C3=CC=C(C=C3)N)C4=CC=C(C=C4)N |
| InChIKey | XTFRSAPDOHNCQC-UHFFFAOYSA-N |
Chemical Property Profile of Pararosaniline, N-sulfophenyl-
Property Insights of Pararosaniline, N-sulfophenyl-
The XLogP value of 3.8 indicates that Pararosaniline, N-sulfophenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pararosaniline, N-sulfophenyl-. Following Lipinski's Rule of Five, Pararosaniline, N-sulfophenyl- has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pararosaniline, N-sulfophenyl-?
The CAS number of Pararosaniline, N-sulfophenyl- is 68966-37-0.
What is the molecular formula of Pararosaniline, N-sulfophenyl-?
The molecular formula of Pararosaniline, N-sulfophenyl- is C25H21N3O3S.
What is the molecular weight of Pararosaniline, N-sulfophenyl-?
The molecular weight of Pararosaniline, N-sulfophenyl- is 443.13037 g/mol.
Where can I buy Pararosaniline, N-sulfophenyl-?
You can request a quote for Pararosaniline, N-sulfophenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pararosaniline, N-sulfophenyl-?
Yes, CoreyChem provides custom synthesis services for Pararosaniline, N-sulfophenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.