![4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid structure](/static/products/492/492441-89-1.png)
4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid
TL;DR: 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid (CAS 492441-89-1) is a chemical compound with molecular formula C10H11BrN2O5 and molecular weight 317.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(5-bromofuran-2-carbonyl)hydrazinyl]-5-oxopentanoic acid
Also Known As: 5-[2-(5-bromo-2-furoyl)hydrazino]-5-oxopentanoic acid, 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid, 5-[2-(5-bromofuran-2-carbonyl)hydrazinyl]-5-oxopentanoic acid, 5-{2-[(5-bromofuran-2-yl)carbonyl]hydrazinyl}-5-oxopentanoic acid
| Molecular Formula | C10H11BrN2O5 |
|---|---|
| Molecular Weight | 317.99 g/mol |
| LogP | 1.058 |
| Topological Polar Surface Area | 108.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.98514 |
| Heavy Atoms | 18 |
| Complexity | 456.87546 |
Chemical Identifiers
| CAS Number | 492441-89-1 |
|---|---|
| SMILES | C1=C(OC(=C1)Br)C(=O)NNC(=O)CCCC(=O)O |
Product Overview
4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid (CAS 492441-89-1), with molecular formula C10H11BrN2O5 and molecular weight 317.99 g/mol. IUPAC: 5-[2-(5-bromofuran-2-carbonyl)hydrazinyl]-5-oxopentanoic acid.
Chemical Property Profile of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid
Property Insights of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid
The XLogP value of 1.058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid. The TPSA of 108.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid. Following Lipinski's Rule of Five, 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid has 3 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 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid?
The CAS number of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid is 492441-89-1.
What is the molecular formula of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid?
The molecular formula of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid is C10H11BrN2O5.
What is the molecular weight of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid?
The molecular weight of 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid is 317.99 g/mol.
Where can I buy 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid?
You can request a quote for 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{N-[(5-bromo-2-furyl)carbonylamino]carbamoyl}butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.