Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate
TL;DR: Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate (CAS 104775-15-7) is a chemical compound with molecular formula C22H25Cl2NO3 and molecular weight 421.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-[[(5-chloro-2-hydroxy-3-methylphenyl)-(4-chlorophenyl)methylidene]amino]heptanoate
Also Known As: Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate, Heptanoic acid, 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)-, methyl ester, Heptanoic acid,6-[[(5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene]amino]-,methyl ester, Pentanoic acid,4-(((4-chlorophenyl)(5-fluoro-2-hydroxyphenyl)methylene)amino)-,methyl ester, methyl 6-[[(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]heptanoate
| Molecular Formula | C22H25Cl2NO3 |
|---|---|
| Molecular Weight | 421.12 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 421.12115 |
| Heavy Atoms | 28 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 104775-15-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)C(=NC(C)CCCCC(=O)OC)C2=CC=C(C=C2)Cl)Cl |
| InChIKey | BDHBEGFOMVQGIL-UHFFFAOYSA-N |
Product Overview
Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate (CAS 104775-15-7), with molecular formula C22H25Cl2NO3 and molecular weight 421.12 g/mol. IUPAC: methyl 6-[[(5-chloro-2-hydroxy-3-methylphenyl)-(4-chlorophenyl)methylidene]amino]heptanoate.
Chemical Property Profile of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate
Property Insights of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate
The XLogP value of 5.9 indicates that Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate?
The CAS number of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate is 104775-15-7.
What is the molecular formula of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate?
The molecular formula of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate is C22H25Cl2NO3.
What is the molecular weight of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate?
The molecular weight of Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate is 421.12 g/mol.
Where can I buy Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate?
You can request a quote for Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 6-(((5-chloro-2-hydroxy-3-methylphenyl)(4-chlorophenyl)methylene)amino)heptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.