![Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate structure](/static/products/395/395072-97-6.png)
Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate
TL;DR: Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate (CAS 395072-97-6) is a chemical compound with molecular formula C21H27N3O5 and molecular weight 401.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate
Also Known As: Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate, methyl 3-(3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanamido)-5-methyl-1H-indole-2-carboxylate, methyl 3-{[3-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)propanoyl]amino}-5-methyl-1H-indole-2-carboxylate
| Molecular Formula | C21H27N3O5 |
|---|---|
| Molecular Weight | 401.20 g/mol |
| LogP | 2.43042 |
| Topological Polar Surface Area | 92.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.19507 |
| Heavy Atoms | 29 |
| Complexity | 906.4225 |
Chemical Identifiers
| CAS Number | 395072-97-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=C2NC(=O)CCN3CCC4(CC3)OCCO4)C(=O)OC |
Product Overview
Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate (CAS 395072-97-6), with molecular formula C21H27N3O5 and molecular weight 401.20 g/mol. IUPAC: methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate.
Chemical Property Profile of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate
Property Insights of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate
The XLogP value of 2.43042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate. The TPSA of 92.89 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate has 2 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 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate?
The CAS number of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate is 395072-97-6.
What is the molecular formula of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate?
The molecular formula of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate is C21H27N3O5.
What is the molecular weight of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate?
The molecular weight of Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate is 401.20 g/mol.
Where can I buy Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate?
You can request a quote for Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-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 Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propanoylamino]-5-methyl-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.