![ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate structure](/static/products/861/861644-86-2.png)
ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate
TL;DR: ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate (CAS 861644-86-2) is a chemical compound with molecular formula C22H29N3O6 and molecular weight 431.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate
Also Known As: ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate, 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-oxoethyl]amino]-5-ethoxy-1H-indole-2-carboxylic acid ethyl ester, ethyl 3-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylacetyl)amino]-5-ethoxy-1H-indole-2-carboxylate, ethyl 3-(2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetamido)-5-ethoxy-1H-indole-2-carboxylate
| Molecular Formula | C22H29N3O6 |
|---|---|
| Molecular Weight | 431.21 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 431.20563 |
| Heavy Atoms | 31 |
| Complexity | 631.0 |
Chemical Identifiers
| CAS Number | 861644-86-2 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCC4(CC3)OCCO4)C(=O)OCC |
| InChIKey | ONLPJGMXXNUEHT-UHFFFAOYSA-N |
Product Overview
ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate (CAS 861644-86-2), with molecular formula C22H29N3O6 and molecular weight 431.21 g/mol. IUPAC: ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate.
Chemical Property Profile of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate
Property Insights of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate has 2 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 ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate?
The CAS number of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate is 861644-86-2.
What is the molecular formula of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate?
The molecular formula of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate is C22H29N3O6.
What is the molecular weight of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate?
The molecular weight of ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate is 431.21 g/mol.
Where can I buy ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate?
You can request a quote for ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-[[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetyl]amino]-5-ethoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.