(Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide
TL;DR: (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide (CAS 896841-17-1) is a chemical compound with molecular formula C25H24N4O4 and molecular weight 444.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3Z)-3-[1-cyano-2-(2,6-dimethylmorpholin-4-yl)-2-oxoethylidene]isoindol-1-yl]-4-methoxybenzamide
Also Known As: (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide, N-[(3Z)-3-[1-cyano-2-(2,6-dimethylmorpholin-4-yl)-2-oxoethylidene]isoindol-1-yl]-4-methoxybenzamide, N-[3-[1-cyano-2-(2,6-dimethylmorpholin-4-yl)-2-oxo-ethylidene]isoindol-1-yl]-4-methoxy-benzamide, N-{(1Z)-1-[1-cyano-2-(2,6-dimethylmorpholin-4-yl)-2-oxoethylidene]-1H-isoindol-3-yl}-4-methoxybenzamide, N-{3-[1-Cyano-2-(2,6-dimethyl-morpholin-4-yl)-2-oxo-eth-(Z)-ylidene]-3H-isoindol-1-yl}-4-methoxy-benz amide
| Molecular Formula | C25H24N4O4 |
|---|---|
| Molecular Weight | 444.18 g/mol |
| LogP | 2.75588 |
| Topological Polar Surface Area | 104.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.17975 |
| Heavy Atoms | 33 |
| Complexity | 1183.6328 |
Chemical Identifiers
| CAS Number | 896841-17-1 |
|---|---|
| SMILES | CC1CN(CC(O1)C)C(=O)/C(=C\2/C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)OC)/C#N |
Product Overview
(Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide (CAS 896841-17-1), with molecular formula C25H24N4O4 and molecular weight 444.18 g/mol. IUPAC: N-[(3Z)-3-[1-cyano-2-(2,6-dimethylmorpholin-4-yl)-2-oxoethylidene]isoindol-1-yl]-4-methoxybenzamide.
Chemical Property Profile of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide
Property Insights of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide
The XLogP value of 2.75588 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide. The TPSA of 104.02 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide. Following Lipinski's Rule of Five, (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide has 1 hydrogen bond donor(s) and 6 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 (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide?
The CAS number of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide is 896841-17-1.
What is the molecular formula of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide?
The molecular formula of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide is C25H24N4O4.
What is the molecular weight of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide?
The molecular weight of (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide is 444.18 g/mol.
Where can I buy (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide?
You can request a quote for (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(1-(1-cyano-2-(2,6-dimethylmorpholino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.