![methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate structure](/static/products/766/766527-80-4.png)
methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate
TL;DR: methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate (CAS 766527-80-4) is a chemical compound with molecular formula C21H19ClN2O4S and molecular weight 430.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-2-morpholin-4-ylbenzoate
Also Known As: methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate, METHYL 5-(3-CHLORO-1-BENZOTHIOPHENE-2-AMIDO)-2-(MORPHOLIN-4-YL)BENZOATE, methyl 5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-2-morpholin-4-ylbenzoate, Methyl 5-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-morpholin-4-yl-benzoate, methyl 5-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-2-(morpholin-4-yl)benzoate
| Molecular Formula | C21H19ClN2O4S |
|---|---|
| Molecular Weight | 430.08 g/mol |
| LogP | 4.4302 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.0754 |
| Heavy Atoms | 29 |
| Complexity | 1075.7284 |
Chemical Identifiers
| CAS Number | 766527-80-4 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)N4CCOCC4 |
Product Overview
methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate (CAS 766527-80-4), with molecular formula C21H19ClN2O4S and molecular weight 430.08 g/mol. IUPAC: methyl 5-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-2-morpholin-4-ylbenzoate.
Chemical Property Profile of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate
Property Insights of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate
The XLogP value of 4.4302 indicates that methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate. Following Lipinski's Rule of Five, methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate has 1 hydrogen bond donor(s) and 6 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 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate?
The CAS number of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate is 766527-80-4.
What is the molecular formula of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate?
The molecular formula of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate is C21H19ClN2O4S.
What is the molecular weight of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate?
The molecular weight of methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate is 430.08 g/mol.
Where can I buy methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate?
You can request a quote for methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-(3-chlorobenzo[b]thiophene-2-carboxamido)-2-morpholinobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.