RefChem:315810
TL;DR: RefChem:315810 (CAS 59180-53-9) is a chemical compound with molecular formula C21H24Cl3N3O3 and molecular weight 471.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]amino]-2-oxoethyl]-propan-2-ylazanium chloride
Also Known As: Acetanilide, 4'-chloro-2'-(o-chlorobenzoyl)-2-(2-(isopropylamino)acetamido)-N-methyl-, hydrochloride, 4'-Chloro-2'-(o-chlorobenzoyl)-2-(2-(isopropylamino)acetamido)-N-methylacetanilide HCl, [2-[[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]amino]-2-oxoethyl]-propan-2-ylazanium chloride, ACETANILIDE, 4'-CHLORO-2'-(o-CHLOROBENZOYL)-2-(2-(ISOPROPYLAMINO)ACETAMIDO)-N-ME, RefChem:315810
| Molecular Formula | C21H24Cl3N3O3 |
|---|---|
| Molecular Weight | 471.09 g/mol |
| LogP | -0.72 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 471.08832 |
| Heavy Atoms | 30 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 59180-53-9 |
|---|---|
| SMILES | CC(C)[NH2+]CC(=O)NCC(=O)N(C)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl.[Cl-] |
| InChIKey | DMCGYBSXTYWXDS-UHFFFAOYSA-N |
Product Overview
RefChem:315810 (CAS 59180-53-9), with molecular formula C21H24Cl3N3O3 and molecular weight 471.09 g/mol. IUPAC: [2-[[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]amino]-2-oxoethyl]-propan-2-ylazanium chloride.
Chemical Property Profile of RefChem:315810
Property Insights of RefChem:315810
The XLogP value of -0.72 indicates that RefChem:315810 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315810. Following Lipinski's Rule of Five, RefChem:315810 has 2 hydrogen bond donor(s) and 4 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 RefChem:315810?
The CAS number of RefChem:315810 is 59180-53-9.
What is the molecular formula of RefChem:315810?
The molecular formula of RefChem:315810 is C21H24Cl3N3O3.
What is the molecular weight of RefChem:315810?
The molecular weight of RefChem:315810 is 471.09 g/mol.
Where can I buy RefChem:315810?
You can request a quote for RefChem:315810 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315810?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315810 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.