![2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid structure](/static/products/5782/5782-84-3.webp)
2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid
TL;DR: 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid (CAS 5782-84-3) is a chemical compound with molecular formula C24H22N4O4S and molecular weight 462.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic acid
Also Known As: 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid, 2-{[(3,7-Diacetamido-10H-phenothiazin-10-yl)methyl]amino}benzoic acid
| Molecular Formula | C24H22N4O4S |
|---|---|
| Molecular Weight | 462.14 g/mol |
| LogP | 4.9739 |
| Topological Polar Surface Area | 110.77 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.13617 |
| Heavy Atoms | 33 |
| Complexity | 1195.4617 |
Chemical Identifiers
| CAS Number | 5782-84-3 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)NC(=O)C)CNC4=CC=CC=C4C(=O)O |
Product Overview
2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid (CAS 5782-84-3), with molecular formula C24H22N4O4S and molecular weight 462.14 g/mol. IUPAC: 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic acid.
Chemical Property Profile of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid
Property Insights of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid
The XLogP value of 4.9739 indicates that 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid. Following Lipinski's Rule of Five, 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid has 4 hydrogen bond donor(s) and 6 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 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid?
The CAS number of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid is 5782-84-3.
What is the molecular formula of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid?
The molecular formula of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid is C24H22N4O4S.
What is the molecular weight of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid?
The molecular weight of 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid is 462.14 g/mol.
Where can I buy 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid?
You can request a quote for 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3,7-diacetamidophenothiazin-10-yl)methylamino]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.