![methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate structure](/static/products/4382/438213-66-2.webp)
methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
TL;DR: methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate (CAS 438213-66-2) is a chemical compound with molecular formula C27H23NO7S and molecular weight 505.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-7-methoxy-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate
Also Known As: methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate, methyl 2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-7-methoxy-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate, METHYL 2-(8-ETHOXY-2-OXO-2H-CHROMENE-3-AMIDO)-7-METHOXY-4H,5H-NAPHTHO[2,1-B]THIOPHENE-1-CARBOXYLATE, methyl 2-(8-ethoxy-2-oxo-2H-chromene-3-carboxamido)-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate, METHYL 2-(8-ETHOXY-2-OXOCHROMENE-3-AMIDO)-7-METHOXY-4H,5H-NAPHTHO[2,1-B]THIOPHENE-1-CARBOXYLATE
| Molecular Formula | C27H23NO7S |
|---|---|
| Molecular Weight | 505.12 g/mol |
| LogP | 5.0663 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.11954 |
| Heavy Atoms | 36 |
| Complexity | 1566.6273 |
Chemical Identifiers
| CAS Number | 438213-66-2 |
|---|---|
| SMILES | CCOC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC3=C(C4=C(S3)CCC5=C4C=CC(=C5)OC)C(=O)OC |
Product Overview
methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate (CAS 438213-66-2), with molecular formula C27H23NO7S and molecular weight 505.12 g/mol. IUPAC: methyl 2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-7-methoxy-4,5-dihydrobenzo[e][1]benzothiole-1-carboxylate.
Chemical Property Profile of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
Property Insights of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
The XLogP value of 5.0663 indicates that methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.07 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate. Following Lipinski's Rule of Five, methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate?
The CAS number of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate is 438213-66-2.
What is the molecular formula of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate?
The molecular formula of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate is C27H23NO7S.
What is the molecular weight of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate?
The molecular weight of methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate is 505.12 g/mol.
Where can I buy methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate?
You can request a quote for methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-7-methoxy-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.