2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide
TL;DR: 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide (CAS 340306-83-4) is a chemical compound with molecular formula C20H16FN5O2 and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide
Also Known As: 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide, (E)-2-(3-((2-(2-cyanoacetyl)hydrazono)methyl)-1H-indol-1-yl)-N-(4-fluorophenyl)acetamide, 2-{3-[(1E)-2-(2-cyanoacetylamino)-2-azavinyl]indolyl}-N-(4-fluorophenyl)acetam ide, 2-(3-{(E)-[2-(cyanoacetyl)hydrazinylidene]methyl}-1H-indol-1-yl)-N-(4-fluorophenyl)acetamide
| Molecular Formula | C20H16FN5O2 |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | 2.78288 |
| Topological Polar Surface Area | 99.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.1288 |
| Heavy Atoms | 28 |
| Complexity | 1080.1643 |
Chemical Identifiers
| CAS Number | 340306-83-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CC(=O)NC3=CC=C(C=C3)F)/C=N/NC(=O)CC#N |
Product Overview
2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide (CAS 340306-83-4), with molecular formula C20H16FN5O2 and molecular weight 377.13 g/mol. IUPAC: 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide.
Chemical Property Profile of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide
Property Insights of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide
The XLogP value of 2.78288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide. The TPSA of 99.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide. Following Lipinski's Rule of Five, 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide has 2 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 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide?
The CAS number of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide is 340306-83-4.
What is the molecular formula of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide?
The molecular formula of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide is C20H16FN5O2.
What is the molecular weight of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide?
The molecular weight of 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide is 377.13 g/mol.
Where can I buy 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide?
You can request a quote for 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-[(E)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.