A4118/0175594
TL;DR: A4118/0175594 (CAS 893769-61-4) is a chemical compound with molecular formula C14H18Cl2N2O3 and molecular weight 332.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[[5-[[(2-chloroacetyl)amino]methyl]-3-hydroxy-2,4-dimethylphenyl]methyl]acetamide
Also Known As: A4118/0175594, 2-chloro-N-[[5-[[(2-chloroacetyl)amino]methyl]-3-hydroxy-2,4-dimethylphenyl]methyl]acetamide, N,N'-[(5-hydroxy-4,6-dimethyl-1,3-phenylene)di(methylene)]bis(2-chloroacetamide), N,N'-[(5-hydroxy-4,6-dimethylbenzene-1,3-diyl)dimethanediyl]bis(2-chloroacetamide), 2-CHLORO-N-({5-[(2-CHLOROACETAMIDO)METHYL]-3-HYDROXY-2,4-DIMETHYLPHENYL}METHYL)ACETAMIDE
| Molecular Formula | C14H18Cl2N2O3 |
|---|---|
| Molecular Weight | 332.07 g/mol |
| LogP | 1.71904 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.06946 |
| Heavy Atoms | 21 |
| Complexity | 503.26093 |
Chemical Identifiers
| CAS Number | 893769-61-4 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1CNC(=O)CCl)CNC(=O)CCl)C)O |
Product Overview
A4118/0175594 (CAS 893769-61-4), with molecular formula C14H18Cl2N2O3 and molecular weight 332.07 g/mol. IUPAC: 2-chloro-N-[[5-[[(2-chloroacetyl)amino]methyl]-3-hydroxy-2,4-dimethylphenyl]methyl]acetamide.
Chemical Property Profile of A4118/0175594
Property Insights of A4118/0175594
The XLogP value of 1.71904 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A4118/0175594. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for A4118/0175594. Following Lipinski's Rule of Five, A4118/0175594 has 3 hydrogen bond donor(s) and 3 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 A4118/0175594?
The CAS number of A4118/0175594 is 893769-61-4.
What is the molecular formula of A4118/0175594?
The molecular formula of A4118/0175594 is C14H18Cl2N2O3.
What is the molecular weight of A4118/0175594?
The molecular weight of A4118/0175594 is 332.07 g/mol.
Where can I buy A4118/0175594?
You can request a quote for A4118/0175594 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4118/0175594?
Yes, KEHONG BIO provides custom synthesis services for A4118/0175594 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.