![4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide structure](/static/products/899/899400-91-0.png)
4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide
TL;DR: 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide (CAS 899400-91-0) is a chemical compound with molecular formula C23H19ClN4O2 and molecular weight 418.12 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-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide
Also Known As: 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide, (Z)-4-chloro-N-(1-(1-cyano-2-oxo-2-(piperidin-1-yl)ethylidene)-1H-isoindol-3-yl)benzamide, 4-chloro-N-{(1Z)-1-[1-cyano-2-oxo-2-(piperidin-1-yl)ethylidene]-1H-isoindol-3-yl}benzamide
| Molecular Formula | C23H19ClN4O2 |
|---|---|
| Molecular Weight | 418.12 g/mol |
| LogP | 3.77738 |
| Topological Polar Surface Area | 85.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 418.11966 |
| Heavy Atoms | 30 |
| Complexity | 1106.7682 |
Chemical Identifiers
| CAS Number | 899400-91-0 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)/C(=C\2/C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)Cl)/C#N |
Product Overview
4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide (CAS 899400-91-0), with molecular formula C23H19ClN4O2 and molecular weight 418.12 g/mol. IUPAC: 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide.
Chemical Property Profile of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide
Property Insights of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide
The XLogP value of 3.77738 indicates that 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide. Following Lipinski's Rule of Five, 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide has 1 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-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide?
The CAS number of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide is 899400-91-0.
What is the molecular formula of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide?
The molecular formula of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide is C23H19ClN4O2.
What is the molecular weight of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide?
The molecular weight of 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide is 418.12 g/mol.
Where can I buy 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide?
You can request a quote for 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)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-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[(3Z)-3-(1-cyano-2-oxo-2-piperidin-1-ylethylidene)isoindol-1-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.