Pararosaniline Pamoate
TL;DR: Pararosaniline Pamoate (CAS 49722-31-8) is a chemical compound with molecular formula C42H33N3O6 and molecular weight 675.23694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid
Also Known As: Pararosaniline Pamoate, PARAROSANILINE PAMOATE ANHYDROUS, 4,4'-Methylenebis(3-hydroxynaphthalene-2-carboxylic acid)--4,4'-[(4-iminocyclohexa-2,5-dien-1-ylidene)methylene]dianiline (1/1), 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline; 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid
Technical Specifications
| Molecular Formula | C42H33N3O6 |
| Molecular Weight | 675.23694 g/mol |
| XLogP | 8.19 |
| Topological Polar Surface Area (TPSA) | 191.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 675.23694 Da |
| Heavy Atoms | 51 |
| Complexity | 1030.0 |
| SMILES | C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O.C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N |
| InChIKey | WSMURVZCWHMKQP-UHFFFAOYSA-N |
Chemical Property Profile of Pararosaniline Pamoate
Property Insights of Pararosaniline Pamoate
The XLogP value of 8.19 indicates that Pararosaniline Pamoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 191.0 Ų indicates high polarity, suggesting Pararosaniline Pamoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pararosaniline Pamoate has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Pararosaniline Pamoate?
The CAS number of Pararosaniline Pamoate is 49722-31-8.
What is the molecular formula of Pararosaniline Pamoate?
The molecular formula of Pararosaniline Pamoate is C42H33N3O6.
What is the molecular weight of Pararosaniline Pamoate?
The molecular weight of Pararosaniline Pamoate is 675.23694 g/mol.
Where can I buy Pararosaniline Pamoate?
You can request a quote for Pararosaniline Pamoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pararosaniline Pamoate?
Yes, CoreyChem provides custom synthesis services for Pararosaniline Pamoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.