N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide
TL;DR: N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide (CAS 500280-12-6) is a chemical compound with molecular formula C21H19N5O4 and molecular weight 405.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(2-cyanoethyl)-2-hydroxyindol-3-yl]imino-2-[(2-phenoxyacetyl)amino]acetamide
Also Known As: N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide, N-[(Z)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide, N-[[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide, (Z)-N-(2-(2-(1-(2-cyanoethyl)-2-oxoindolin-3-ylidene)hydrazinyl)-2-oxoethyl)-2-phenoxyacetamide, N-(2-{(2Z)-2-[1-(2-cyanoethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-2-oxoethyl)-2-phenoxyacetamide (non-preferred name)
| Molecular Formula | C21H19N5O4 |
|---|---|
| Molecular Weight | 405.14 g/mol |
| LogP | 3.06608 |
| Topological Polar Surface Area | 129.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 405.1437 |
| Heavy Atoms | 30 |
| Complexity | 1115.6223 |
Chemical Identifiers
| CAS Number | 500280-12-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(=O)NCC(=O)N=NC2=C(N(C3=CC=CC=C32)CCC#N)O |
Product Overview
N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide (CAS 500280-12-6), with molecular formula C21H19N5O4 and molecular weight 405.14 g/mol. IUPAC: N-[1-(2-cyanoethyl)-2-hydroxyindol-3-yl]imino-2-[(2-phenoxyacetyl)amino]acetamide.
Chemical Property Profile of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide
Property Insights of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide
The XLogP value of 3.06608 indicates that N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide. Following Lipinski's Rule of Five, N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide has 2 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 N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide?
The CAS number of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide is 500280-12-6.
What is the molecular formula of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide?
The molecular formula of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide is C21H19N5O4.
What is the molecular weight of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide?
The molecular weight of N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide is 405.14 g/mol.
Where can I buy N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide?
You can request a quote for N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-[1-(2-cyanoethyl)-2-oxoindol-3-ylidene]amino]-2-[(2-phenoxyacetyl)amino]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.