![1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester structure](/static/products/840/840463-55-0.png)
1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester
TL;DR: 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester (CAS 840463-55-0) is a chemical compound with molecular formula C17H20FN3O3 and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-fluoro-3-(3-pyrrolidin-1-ylpropanoylamino)-1H-indole-2-carboxylate
Also Known As: 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester, methyl 5-fluoro-3-(3-(pyrrolidin-1-yl)propanamido)-1H-indole-2-carboxylate, methyl 5-fluoro-3-(3-pyrrolidin-1-ylpropanoylamino)-1H-indole-2-carboxylate, methyl 5-fluoro-3-{[3-(pyrrolidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
| Molecular Formula | C17H20FN3O3 |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | 2.518 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.14886 |
| Heavy Atoms | 24 |
| Complexity | 765.77167 |
Chemical Identifiers
| CAS Number | 840463-55-0 |
|---|---|
| SMILES | COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CCN3CCCC3 |
Product Overview
1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester (CAS 840463-55-0), with molecular formula C17H20FN3O3 and molecular weight 333.15 g/mol. IUPAC: methyl 5-fluoro-3-(3-pyrrolidin-1-ylpropanoylamino)-1H-indole-2-carboxylate.
Chemical Property Profile of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester
Property Insights of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester
The XLogP value of 2.518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester. Following Lipinski's Rule of Five, 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester has 2 hydrogen bond donor(s) and 4 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 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester?
The CAS number of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester is 840463-55-0.
What is the molecular formula of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester?
The molecular formula of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester is C17H20FN3O3.
What is the molecular weight of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester?
The molecular weight of 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester is 333.15 g/mol.
Where can I buy 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester?
You can request a quote for 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-2-carboxylic acid, 5-fluoro-3-[3-(pyrrolidin-1-yl)propionylamino]-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.