ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate
TL;DR: ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate (CAS 799819-68-4) is a chemical compound with molecular formula C20H25BrN4O4 and molecular weight 464.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-bromo-3-[3-(4-carbamoylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate
Also Known As: ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate, Ethyl 5-bromo-3-[3-(4-carbamoyl-1-piperidyl)propanoylamino]-1H-indole-2-carboxylate, ethyl 5-bromo-3-[3-(4-carbamoylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate, ethyl 5-bromo-3-{[3-(4-carbamoylpiperidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
| Molecular Formula | C20H25BrN4O4 |
|---|---|
| Molecular Weight | 464.11 g/mol |
| LogP | 2.633 |
| Topological Polar Surface Area | 117.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 464.10593 |
| Heavy Atoms | 29 |
| Complexity | 918.5871 |
Chemical Identifiers
| CAS Number | 799819-68-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CCN3CCC(CC3)C(=O)N |
Product Overview
ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate (CAS 799819-68-4), with molecular formula C20H25BrN4O4 and molecular weight 464.11 g/mol. IUPAC: ethyl 5-bromo-3-[3-(4-carbamoylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate.
Chemical Property Profile of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate
Property Insights of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate
The XLogP value of 2.633 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate. The TPSA of 117.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate has 3 hydrogen bond donor(s) and 5 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 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate?
The CAS number of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate is 799819-68-4.
What is the molecular formula of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate?
The molecular formula of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate is C20H25BrN4O4.
What is the molecular weight of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate?
The molecular weight of ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate is 464.11 g/mol.
Where can I buy ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate?
You can request a quote for ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-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 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-bromo-3-(3-(4-carbamoylpiperidin-1-yl)propanamido)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.