![Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate structure](/static/products/2074/20745-75-9.webp)
Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate
TL;DR: Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate (CAS 20745-75-9) is a chemical compound with molecular formula C16H15ClN2O4 and molecular weight 334.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate
Also Known As: methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate
| Molecular Formula | C16H15ClN2O4 |
|---|---|
| Molecular Weight | 334.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.07202 |
| Heavy Atoms | 23 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 20745-75-9 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)Cl)OCC(=O)NC2=CC=CC(=C2)N |
| InChIKey | NOOPAOHYOHBUIR-UHFFFAOYSA-N |
Product Overview
Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate (CAS 20745-75-9), with molecular formula C16H15ClN2O4 and molecular weight 334.07 g/mol. IUPAC: methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate.
Chemical Property Profile of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate
Property Insights of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate. Following Lipinski's Rule of Five, Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate has 2 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 Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate?
The CAS number of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate is 20745-75-9.
What is the molecular formula of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate?
The molecular formula of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate is C16H15ClN2O4.
What is the molecular weight of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate?
The molecular weight of Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate is 334.07 g/mol.
Where can I buy Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate?
You can request a quote for Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[2-(3-aminoanilino)-2-oxoethoxy]-5-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.