methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
TL;DR: methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate (CAS 327099-75-2) is a chemical compound with molecular formula C19H16Cl2F3NO4 and molecular weight 449.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(3,4-dichlorobenzoyl)-methylamino]-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Also Known As: methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate, methyl 2-(4-{[(3,4-dichlorophenyl)carbonyl](methyl)amino}-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate, methyl 2-[4-[(3,4-dichlorobenzoyl)-methylamino]-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoate
| Molecular Formula | C19H16Cl2F3NO4 |
|---|---|
| Molecular Weight | 449.04 g/mol |
| LogP | 4.50132 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.04086 |
| Heavy Atoms | 29 |
| Complexity | 964.9558 |
Chemical Identifiers
| CAS Number | 327099-75-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)N(C)C(=O)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate (CAS 327099-75-2), with molecular formula C19H16Cl2F3NO4 and molecular weight 449.04 g/mol. IUPAC: methyl 2-[4-[(3,4-dichlorobenzoyl)-methylamino]-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoate.
Chemical Property Profile of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
Property Insights of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
The XLogP value of 4.50132 indicates that methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate. Following Lipinski's Rule of Five, methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate has 1 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 methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate?
The CAS number of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate is 327099-75-2.
What is the molecular formula of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate?
The molecular formula of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate is C19H16Cl2F3NO4.
What is the molecular weight of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate?
The molecular weight of methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate is 449.04 g/mol.
Where can I buy methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate?
You can request a quote for methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(4-(3,4-dichloro-N-methylbenzamido)-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.