ACRIDINIUM,10-METHYL-,CHLORIDE
TL;DR: ACRIDINIUM,10-METHYL-,CHLORIDE (CAS 5776-57-8) is a chemical compound with molecular formula C23H21Cl3N2O5 and molecular weight 510.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-chlorophenyl)-1-(3,5-dichloro-2-hydroxyphenyl)-3-(2-methylpropyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid
Also Known As: ACRIDINIUM,10-METHYL-,CHLORIDE, A2879/0121367, 3-(3-chlorophenyl)-6-(3,5-dichloro-2-hydroxy-phenyl)-8-(2-methylpropyl)-2,4-dioxo-3,7-diazabicyclo[3.3.0]octane-8-carboxylic acid, 5-(3-chlorophenyl)-1-(3,5-dichloro-2-hydroxyphenyl)-3-(2-methylpropyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid, 5-(3-chlorophenyl)-3-(3,5-dichloro-2-hydroxyphenyl)-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
| Molecular Formula | C23H21Cl3N2O5 |
|---|---|
| Molecular Weight | 510.05 g/mol |
| LogP | 4.672 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 510.0516 |
| Heavy Atoms | 33 |
| Complexity | 1170.781 |
Chemical Identifiers
| CAS Number | 5776-57-8 |
|---|---|
| SMILES | CC(C)CC1(C2C(C(N1)C3=C(C(=CC(=C3)Cl)Cl)O)C(=O)N(C2=O)C4=CC(=CC=C4)Cl)C(=O)O |
Product Overview
ACRIDINIUM,10-METHYL-,CHLORIDE (CAS 5776-57-8), with molecular formula C23H21Cl3N2O5 and molecular weight 510.05 g/mol. IUPAC: 5-(3-chlorophenyl)-1-(3,5-dichloro-2-hydroxyphenyl)-3-(2-methylpropyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid.
Chemical Property Profile of ACRIDINIUM,10-METHYL-,CHLORIDE
Property Insights of ACRIDINIUM,10-METHYL-,CHLORIDE
The XLogP value of 4.672 indicates that ACRIDINIUM,10-METHYL-,CHLORIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for ACRIDINIUM,10-METHYL-,CHLORIDE. Following Lipinski's Rule of Five, ACRIDINIUM,10-METHYL-,CHLORIDE has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ACRIDINIUM,10-METHYL-,CHLORIDE?
The CAS number of ACRIDINIUM,10-METHYL-,CHLORIDE is 5776-57-8.
What is the molecular formula of ACRIDINIUM,10-METHYL-,CHLORIDE?
The molecular formula of ACRIDINIUM,10-METHYL-,CHLORIDE is C23H21Cl3N2O5.
What is the molecular weight of ACRIDINIUM,10-METHYL-,CHLORIDE?
The molecular weight of ACRIDINIUM,10-METHYL-,CHLORIDE is 510.05 g/mol.
Where can I buy ACRIDINIUM,10-METHYL-,CHLORIDE?
You can request a quote for ACRIDINIUM,10-METHYL-,CHLORIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ACRIDINIUM,10-METHYL-,CHLORIDE?
Yes, KEHONG BIO provides custom synthesis services for ACRIDINIUM,10-METHYL-,CHLORIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.