CTK8I4972
TL;DR: CTK8I4972 (CAS 3796-01-8) is a chemical compound with molecular formula C25H33N3O5 and molecular weight 455.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[2-(diethylamino)ethylamino]-3-oxo-1-(3,4,5-trimethoxyphenyl)prop-1-en-2-yl]benzamide
Also Known As: alpha-Benzamido-N-(2-(diethylamino)ethyl)-3,4,5-trimethoxycinnamamide, N-[3-[2-(diethylamino)ethylamino]-3-oxo-1-(3,4,5-trimethoxyphenyl)prop-1-en-2-yl]benzamide
| Molecular Formula | C25H33N3O5 |
|---|---|
| Molecular Weight | 455.24 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 455.24203 |
| Heavy Atoms | 33 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 3796-01-8 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C(=CC1=CC(=C(C(=C1)OC)OC)OC)NC(=O)C2=CC=CC=C2 |
| InChIKey | JLFNYXMAGOZJGX-UHFFFAOYSA-N |
Product Overview
CTK8I4972 (CAS 3796-01-8), with molecular formula C25H33N3O5 and molecular weight 455.24 g/mol. IUPAC: N-[3-[2-(diethylamino)ethylamino]-3-oxo-1-(3,4,5-trimethoxyphenyl)prop-1-en-2-yl]benzamide.
Chemical Property Profile of CTK8I4972
Property Insights of CTK8I4972
The XLogP value of 3.4 indicates that CTK8I4972 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8I4972. Following Lipinski's Rule of Five, CTK8I4972 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 CTK8I4972?
The CAS number of CTK8I4972 is 3796-01-8.
What is the molecular formula of CTK8I4972?
The molecular formula of CTK8I4972 is C25H33N3O5.
What is the molecular weight of CTK8I4972?
The molecular weight of CTK8I4972 is 455.24 g/mol.
Where can I buy CTK8I4972?
You can request a quote for CTK8I4972 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8I4972?
Yes, KEHONG BIO provides custom synthesis services for CTK8I4972 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.