![Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate structure](/static/products/4778/477889-94-4.webp)
Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate
TL;DR: Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate (CAS 477889-94-4) is a chemical compound with molecular formula C18H17NO5 and molecular weight 327.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-acetamido-2-(3-methylbenzoyl)oxybenzoate
Also Known As: methyl 4-acetamido-2-(3-methylbenzoyloxy)benzoate, methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate, methyl 4-acetamido-2-(3-methylbenzoyl)oxybenzoate, methyl4-acetamido-2-(3-methylbenzoyloxy)benzoate, 2R-0692
| Molecular Formula | C18H17NO5 |
|---|---|
| Molecular Weight | 327.11 g/mol |
| LogP | 2.95922 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.1107 |
| Heavy Atoms | 24 |
| Complexity | 797.74615 |
Chemical Identifiers
| CAS Number | 477889-94-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)OC2=C(C=CC(=C2)NC(=O)C)C(=O)OC |
Product Overview
Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate (CAS 477889-94-4), with molecular formula C18H17NO5 and molecular weight 327.11 g/mol. IUPAC: methyl 4-acetamido-2-(3-methylbenzoyl)oxybenzoate.
Chemical Property Profile of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate
Property Insights of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate
The XLogP value of 2.95922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate. Following Lipinski's Rule of Five, Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate has 1 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 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate?
The CAS number of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate is 477889-94-4.
What is the molecular formula of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate?
The molecular formula of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate is C18H17NO5.
What is the molecular weight of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate?
The molecular weight of Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate is 327.11 g/mol.
Where can I buy Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate?
You can request a quote for Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(acetylamino)-2-[(3-methylbenzoyl)oxy]benzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.