N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide
TL;DR: N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide (CAS 2792-95-2) is a chemical compound with molecular formula C22H23IN2O3 and molecular weight 490.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[7-(diethylamino)-4-methyl-2-oxochromen-3-yl]phenyl]-2-iodoacetamide
Also Known As: DCIA, Demcpi, N-(4-(7-Diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide, N-[4-[7-(diethylamino)-4-methyl-2-oxochromen-3-yl]phenyl]-2-iodoacetamide, 7-Diethylamino-3-[4- phenyl]-4-methylcoumarin
| Molecular Formula | C22H23IN2O3 |
|---|---|
| Molecular Weight | 490.08 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 490.07535 |
| Heavy Atoms | 28 |
| Complexity | 609.0 |
Chemical Identifiers
| CAS Number | 2792-95-2 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=C(C=C3)NC(=O)CI)C |
| InChIKey | WIXAQXKQLNRFDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide (CAS 2792-95-2), with molecular formula C22H23IN2O3 and molecular weight 490.08 g/mol. IUPAC: N-[4-[7-(diethylamino)-4-methyl-2-oxochromen-3-yl]phenyl]-2-iodoacetamide.
Chemical Property Profile of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide
Property Insights of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide
The XLogP value of 4.2 indicates that N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide has 1 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 N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide?
The CAS number of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide is 2792-95-2.
What is the molecular formula of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide?
The molecular formula of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide is C22H23IN2O3.
What is the molecular weight of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide?
The molecular weight of N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide is 490.08 g/mol.
Where can I buy N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide?
You can request a quote for N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(7-diethylamino 4-methylcoumarin-3-yl)phenyl)iodoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.