Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate
TL;DR: Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate (CAS 925059-10-5) is a chemical compound with molecular formula C11H14BrN3O3 and molecular weight 315.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(5-bromo-2-pyridinyl)carbamoylamino]propanoate
Also Known As: ethyl 3-(3-(5-bromopyridin-2-yl)ureido)propanoate, ETHYL 3-((N-(5-BROMO-2-PYRIDYL)CARBAMOYL)AMINO)PROPANOATE, Ethyl 3-[(5-bromopyridin-2-yl)carbamoylamino]propanoate, ethyl 3-[(5-bromo-2-pyridyl)carbamoylamino]propanoate, ethyl N-[(5-bromopyridin-2-yl)carbamoyl]-beta-alaninate
| Molecular Formula | C11H14BrN3O3 |
|---|---|
| Molecular Weight | 315.02 g/mol |
| LogP | 1.9188 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.02185 |
| Heavy Atoms | 18 |
| Complexity | 408.4994 |
Chemical Identifiers
| CAS Number | 925059-10-5 |
|---|---|
| SMILES | CCOC(=O)CCNC(=O)NC1=NC=C(C=C1)Br |
Product Overview
Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate (CAS 925059-10-5), with molecular formula C11H14BrN3O3 and molecular weight 315.02 g/mol. IUPAC: ethyl 3-[(5-bromo-2-pyridinyl)carbamoylamino]propanoate.
Chemical Property Profile of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate
Property Insights of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate
The XLogP value of 1.9188 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate. Following Lipinski's Rule of Five, Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate 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 Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate?
The CAS number of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate is 925059-10-5.
What is the molecular formula of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate?
The molecular formula of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate is C11H14BrN3O3.
What is the molecular weight of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate?
The molecular weight of Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate is 315.02 g/mol.
Where can I buy Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate?
You can request a quote for Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-((N-(5-bromo-2-pyridyl)carbamoyl)amino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.