7-Diethylamino-3-iodo-4-methyl-chromen-2-one
TL;DR: 7-Diethylamino-3-iodo-4-methyl-chromen-2-one (CAS 107995-74-4) is a chemical compound with molecular formula C14H16INO2 and molecular weight 357.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(diethylamino)-3-iodo-4-methylchromen-2-one
Also Known As: 3-iodo-4-methyl-7-diethylaminocoumarin, BAS 00231954, 7-Diethylamino-3-iodo-4-methyl-chromen-2-one, 7-(diethylamino)-3-iodo-4-methylchromen-2-one, 7-(Diethylamino)-3-iodo-4-methyl-2H-chromen-2-one
| Molecular Formula | C14H16INO2 |
|---|---|
| Molecular Weight | 357.02 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.02258 |
| Heavy Atoms | 18 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 107995-74-4 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)I)C |
| InChIKey | DRTYANIJZQWONA-UHFFFAOYSA-N |
Product Overview
7-Diethylamino-3-iodo-4-methyl-chromen-2-one (CAS 107995-74-4), with molecular formula C14H16INO2 and molecular weight 357.02 g/mol. IUPAC: 7-(diethylamino)-3-iodo-4-methylchromen-2-one.
Chemical Property Profile of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one
Property Insights of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one
The XLogP value of 3.3 indicates that 7-Diethylamino-3-iodo-4-methyl-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 7-Diethylamino-3-iodo-4-methyl-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Diethylamino-3-iodo-4-methyl-chromen-2-one has 0 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 7-Diethylamino-3-iodo-4-methyl-chromen-2-one?
The CAS number of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one is 107995-74-4.
What is the molecular formula of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one?
The molecular formula of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one is C14H16INO2.
What is the molecular weight of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one?
The molecular weight of 7-Diethylamino-3-iodo-4-methyl-chromen-2-one is 357.02 g/mol.
Where can I buy 7-Diethylamino-3-iodo-4-methyl-chromen-2-one?
You can request a quote for 7-Diethylamino-3-iodo-4-methyl-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Diethylamino-3-iodo-4-methyl-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Diethylamino-3-iodo-4-methyl-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.