![4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide structure](/static/products/896/896598-78-0.png)
4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide
TL;DR: 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide (CAS 896598-78-0) is a chemical compound with molecular formula C23H15ClN4O3 and molecular weight 430.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(3Z)-3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]benzamide
Also Known As: 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide, (Z)-4-chloro-N-(1-(1-cyano-2-((furan-2-ylmethyl)amino)-2-oxoethylidene)-1H-isoindol-3-yl)benzamide, 4-chloro-N-[(1Z)-1-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide, 4-chloro-N-[(3Z)-3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]benzamide
| Molecular Formula | C23H15ClN4O3 |
|---|---|
| Molecular Weight | 430.08 g/mol |
| LogP | 3.67428 |
| Topological Polar Surface Area | 107.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.08328 |
| Heavy Atoms | 31 |
| Complexity | 1252.7286 |
Chemical Identifiers
| CAS Number | 896598-78-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)/C(=C(\C#N)/C(=O)NCC3=CC=CO3)/N=C2NC(=O)C4=CC=C(C=C4)Cl |
Product Overview
4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide (CAS 896598-78-0), with molecular formula C23H15ClN4O3 and molecular weight 430.08 g/mol. IUPAC: 4-chloro-N-[(3Z)-3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]benzamide.
Chemical Property Profile of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide
Property Insights of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide
The XLogP value of 3.67428 indicates that 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide. Following Lipinski's Rule of Five, 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide has 2 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 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide?
The CAS number of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide is 896598-78-0.
What is the molecular formula of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide?
The molecular formula of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide is C23H15ClN4O3.
What is the molecular weight of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide?
The molecular weight of 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide is 430.08 g/mol.
Where can I buy 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide?
You can request a quote for 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[3-[cyano-(2-furylmethylcarbamoyl)methylidene]isoindol-1-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.