RefChem:482069
TL;DR: RefChem:482069 (CAS 24140-33-8) is a chemical compound with molecular formula C22H22N2O2 and molecular weight 346.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-2-methylbutyl] 3-[4-[(4-cyanophenyl)methylideneamino]phenyl]prop-2-enoate
Also Known As: 2-Propenoic acid, 3-(4-(((4-cyanophenyl)methylene)amino)phenyl)-, (2S)-2-methylbutyl ester, 2-Propenoic acid, 3-[4-[[(4-cyanophenyl)methylene]amino]phenyl]-, (2S)-2-methylbutyl ester, (2S)-2-methylbutyl 3-(4-{[(4-cyanophenyl)methylidene]amino}phenyl)prop-2-enoate, [(2S)-2-methylbutyl] 3-[4-[(4-cyanophenyl)methylideneamino]phenyl]prop-2-enoate, 4-((
| Molecular Formula | C22H22N2O2 |
|---|---|
| Molecular Weight | 346.17 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 62.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 346.16812 |
| Heavy Atoms | 26 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 24140-33-8 |
|---|---|
| SMILES | CC[C@H](C)COC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C#N |
| InChIKey | QBHAGCFAQGQZGQ-KRWDZBQOSA-N |
Product Overview
RefChem:482069 (CAS 24140-33-8), with molecular formula C22H22N2O2 and molecular weight 346.17 g/mol. IUPAC: [(2S)-2-methylbutyl] 3-[4-[(4-cyanophenyl)methylideneamino]phenyl]prop-2-enoate.
Chemical Property Profile of RefChem:482069
Property Insights of RefChem:482069
The XLogP value of 4.9 indicates that RefChem:482069 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:482069. Following Lipinski's Rule of Five, RefChem:482069 has 0 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 RefChem:482069?
The CAS number of RefChem:482069 is 24140-33-8.
What is the molecular formula of RefChem:482069?
The molecular formula of RefChem:482069 is C22H22N2O2.
What is the molecular weight of RefChem:482069?
The molecular weight of RefChem:482069 is 346.17 g/mol.
Where can I buy RefChem:482069?
You can request a quote for RefChem:482069 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:482069?
Yes, KEHONG BIO provides custom synthesis services for RefChem:482069 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.