(E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide
TL;DR: (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide (CAS 1164548-31-5) is a chemical compound with molecular formula C22H20FN3O and molecular weight 361.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide
Also Known As: (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide, (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethyl-2-indolylidene)-2-butenamide, (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindolin-2-ylidene)but-2-enamide, 2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene)but-2-enamide
| Molecular Formula | C22H20FN3O |
|---|---|
| Molecular Weight | 361.16 g/mol |
| LogP | 4.52568 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.15903 |
| Heavy Atoms | 27 |
| Complexity | 998.6126 |
Chemical Identifiers
| CAS Number | 1164548-31-5 |
|---|---|
| SMILES | CC\1(C2=CC=CC=C2N(/C1=C\C=C(/C#N)\C(=O)NC3=CC=CC=C3F)C)C |
Product Overview
(E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide (CAS 1164548-31-5), with molecular formula C22H20FN3O and molecular weight 361.16 g/mol. IUPAC: (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide.
Chemical Property Profile of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide
Property Insights of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide
The XLogP value of 4.52568 indicates that (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.13 Ų, (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide has 1 hydrogen bond donor(s) and 3 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 (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide?
The CAS number of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide is 1164548-31-5.
What is the molecular formula of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide?
The molecular formula of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide is C22H20FN3O.
What is the molecular weight of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide?
The molecular weight of (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide is 361.16 g/mol.
Where can I buy (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide?
You can request a quote for (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E,4Z)-2-cyano-N-(2-fluorophenyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.