![4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid structure](/static/products/5191/519147-40-1.webp)
4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid
TL;DR: 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid (CAS 519147-40-1) is a chemical compound with molecular formula C16H16N2O5 and molecular weight 316.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(furan-2-carbonylamino)anilino]-5-oxopentanoic acid
Also Known As: TimTec1_008047, BAS 06636205, IDI1_033701, 5-[3-(furan-2-carbonylamino)anilino]-5-oxopentanoic acid, 4-{3-[(Furan-2-carbonyl)-amino]-phenylcarbamoyl}-butyric acid
| Molecular Formula | C16H16N2O5 |
|---|---|
| Molecular Weight | 316.11 g/mol |
| LogP | 2.7253 |
| Topological Polar Surface Area | 108.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.10593 |
| Heavy Atoms | 23 |
| Complexity | 694.256 |
Chemical Identifiers
| CAS Number | 519147-40-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C2=CC=CO2)NC(=O)CCCC(=O)O |
Product Overview
4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid (CAS 519147-40-1), with molecular formula C16H16N2O5 and molecular weight 316.11 g/mol. IUPAC: 5-[3-(furan-2-carbonylamino)anilino]-5-oxopentanoic acid.
Chemical Property Profile of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid
Property Insights of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid
The XLogP value of 2.7253 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid. The TPSA of 108.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid. Following Lipinski's Rule of Five, 4-{N-[3-(2-furylcarbonylamino)phenyl]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-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid?
The CAS number of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid is 519147-40-1.
What is the molecular formula of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid?
The molecular formula of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid is C16H16N2O5.
What is the molecular weight of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid?
The molecular weight of 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid is 316.11 g/mol.
Where can I buy 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid?
You can request a quote for 4-{N-[3-(2-furylcarbonylamino)phenyl]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-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{N-[3-(2-furylcarbonylamino)phenyl]carbamoyl}butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.