![methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate structure](/static/products/846/846586-90-1.png)
methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
TL;DR: methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate (CAS 846586-90-1) is a chemical compound with molecular formula C22H23FN4O5 and molecular weight 442.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-fluoro-3-[3-[4-(furan-2-carbonyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
Also Known As: methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate, methyl 5-fluoro-3-(3-(4-(furan-2-carbonyl)piperazin-1-yl)propanamido)-1H-indole-2-carboxylate, methyl 5-fluoro-3-[3-[4-(furan-2-carbonyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
| Molecular Formula | C22H23FN4O5 |
|---|---|
| Molecular Weight | 442.17 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.16525 |
| Heavy Atoms | 32 |
| Complexity | 702.0 |
Chemical Identifiers
| CAS Number | 846586-90-1 |
|---|---|
| SMILES | COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CCN3CCN(CC3)C(=O)C4=CC=CO4 |
| InChIKey | VVZFVOXJYLDJLO-UHFFFAOYSA-N |
Product Overview
methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate (CAS 846586-90-1), with molecular formula C22H23FN4O5 and molecular weight 442.17 g/mol. IUPAC: methyl 5-fluoro-3-[3-[4-(furan-2-carbonyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Property Insights of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-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 methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
The CAS number of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate is 846586-90-1.
What is the molecular formula of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
The molecular formula of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate is C22H23FN4O5.
What is the molecular weight of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
The molecular weight of methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate is 442.17 g/mol.
Where can I buy methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
You can request a quote for methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-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 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-fluoro-3-({3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.