RefChem:1075223
TL;DR: RefChem:1075223 (CAS 97702-84-6) is a chemical compound with molecular formula C23H28ClN3O5 and molecular weight 461.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(5-chloro-2-methylanilino)-2-phenylacetyl]amino]ethyl-dimethylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: Acetamide, 2-(5-chloro-o-toluidino)-N-(2-(dimethylamino)ethyl)-2-phenyl-, maleate, 2-(5-Chloro-o-toluidino)-N-(2-(dimethylamino)ethyl)-2-phenylacetamide maleate, 2-[[2-(5-chloro-2-methylanilino)-2-phenylacetyl]amino]ethyl-dimethylazanium; (Z)-4-hydroxy-4-oxobut-2-enoate
| Molecular Formula | C23H28ClN3O5 |
|---|---|
| Molecular Weight | 461.17 g/mol |
| LogP | 0.43942 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 461.17175 |
| Heavy Atoms | 32 |
| Complexity | 916.484 |
Chemical Identifiers
| CAS Number | 97702-84-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)NC(C2=CC=CC=C2)C(=O)NCC[NH+](C)C.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
RefChem:1075223 (CAS 97702-84-6), with molecular formula C23H28ClN3O5 and molecular weight 461.17 g/mol. IUPAC: 2-[[2-(5-chloro-2-methylanilino)-2-phenylacetyl]amino]ethyl-dimethylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of RefChem:1075223
Property Insights of RefChem:1075223
The XLogP value of 0.43942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1075223. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1075223. Following Lipinski's Rule of Five, RefChem:1075223 has 4 hydrogen bond donor(s) and 5 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:1075223?
The CAS number of RefChem:1075223 is 97702-84-6.
What is the molecular formula of RefChem:1075223?
The molecular formula of RefChem:1075223 is C23H28ClN3O5.
What is the molecular weight of RefChem:1075223?
The molecular weight of RefChem:1075223 is 461.17 g/mol.
Where can I buy RefChem:1075223?
You can request a quote for RefChem:1075223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075223?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.