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Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate
TL;DR: Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate (CAS 31722-15-3) is a chemical compound with molecular formula C14H17NO5 and molecular weight 279.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate
Also Known As: methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate, METHYL 2-(5-METHOXY-5-OXOPENTANAMIDO)BENZOATE, methyl 4-{N-[2-(methoxycarbonyl)phenyl]carbamoyl}butanoate
| Molecular Formula | C14H17NO5 |
|---|---|
| Molecular Weight | 279.11 g/mol |
| LogP | 1.755 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.1107 |
| Heavy Atoms | 20 |
| Complexity | 498.09256 |
Chemical Identifiers
| CAS Number | 31722-15-3 |
|---|---|
| SMILES | COC(=O)CCCC(=O)NC1=CC=CC=C1C(=O)OC |
Product Overview
Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate (CAS 31722-15-3), with molecular formula C14H17NO5 and molecular weight 279.11 g/mol. IUPAC: methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate.
Chemical Property Profile of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate
Property Insights of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate
The XLogP value of 1.755 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate. Following Lipinski's Rule of Five, Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate 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 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate?
The CAS number of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate is 31722-15-3.
What is the molecular formula of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate?
The molecular formula of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate is C14H17NO5.
What is the molecular weight of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate?
The molecular weight of Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate is 279.11 g/mol.
Where can I buy Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate?
You can request a quote for Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(5-methoxy-5-oxopentanoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.