3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid
TL;DR: 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid (CAS 5858-13-9) is a chemical compound with molecular formula C13H14N4O7S2 and molecular weight 402.0304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-5-[(4-amino-3-sulfophenyl)carbamoylamino]benzenesulfonic acid
Also Known As: 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid, 1,3-Bis(3-sulfo-4-aminophenyl)urea, 3,3'-(carbonyldiimino)bis[6-aminobenzenesulphonic] acid, 2-amino-5-[(4-amino-3-sulfophenyl)carbamoylamino]benzenesulfonic acid, Benzenesulfonic acid, 3,3'-ureylenebis[6-amino-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H14N4O7S2 |
| Molecular Weight | 402.0304 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 219.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.0304 Da |
| Heavy Atoms | 26 |
| Complexity | 656.0 |
| SMILES | C1=CC(=C(C=C1NC(=O)NC2=CC(=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O)N |
| InChIKey | HTCKYPGNOXCXNS-UHFFFAOYSA-N |
Chemical Property Profile of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid
Property Insights of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid
The XLogP value of -0.3 indicates that 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 219.0 Ų indicates high polarity, suggesting 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid has 6 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 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid?
The CAS number of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid is 5858-13-9.
What is the molecular formula of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid?
The molecular formula of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid is C13H14N4O7S2.
What is the molecular weight of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid?
The molecular weight of 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid is 402.0304 g/mol.
Where can I buy 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid?
You can request a quote for 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid?
Yes, CoreyChem provides custom synthesis services for 3,3'-(Carbonyldiimino)bis(6-aminobenzenesulphonic) acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.