![methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate structure](/static/products/904/904697-27-4.png)
methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate
TL;DR: methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate (CAS 904697-27-4) is a chemical compound with molecular formula C17H24N2O5S and molecular weight 368.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate
Also Known As: methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate, methyl 2-(2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetamido)-5-ethylthiophene-3-carboxylate, Methyl 2-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethyl-thiophene-3-carboxylate, methyl 2-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate, methyl 2-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)acetylamino]-5-ethylthiophene-3 -carboxylate
| Molecular Formula | C17H24N2O5S |
|---|---|
| Molecular Weight | 368.14 g/mol |
| LogP | 1.8745 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1406 |
| Heavy Atoms | 25 |
| Complexity | 628.9828 |
Chemical Identifiers
| CAS Number | 904697-27-4 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=O)CN2CCC3(CC2)OCCO3)C(=O)OC |
Product Overview
methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate (CAS 904697-27-4), with molecular formula C17H24N2O5S and molecular weight 368.14 g/mol. IUPAC: methyl 2-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate.
Chemical Property Profile of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate
Property Insights of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate
The XLogP value of 1.8745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 7 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-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate?
The CAS number of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate is 904697-27-4.
What is the molecular formula of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate?
The molecular formula of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate is C17H24N2O5S.
What is the molecular weight of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate?
The molecular weight of methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate is 368.14 g/mol.
Where can I buy methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate?
You can request a quote for methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-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-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.