4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde
TL;DR: 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde (CAS 136918-65-5) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(benzylamino)-7-(diethylamino)-2-oxochromene-3-carbaldehyde
Also Known As: BAS 00231825, 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde, AE-848/30736037, 4-(benzylamino)-7-(diethylamino)-2-oxochromene-3-carbaldehyde, 4-Benzylamino-7-diethylamino-2-oxo-2H-chromene-3-carbaldehyde
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 4.0638 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 960.1473 |
Chemical Identifiers
| CAS Number | 136918-65-5 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C=O)NCC3=CC=CC=C3 |
Product Overview
4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde (CAS 136918-65-5), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: 4-(benzylamino)-7-(diethylamino)-2-oxochromene-3-carbaldehyde.
Chemical Property Profile of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde
Property Insights of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde
The XLogP value of 4.0638 indicates that 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde. Following Lipinski's Rule of Five, 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde has 1 hydrogen bond donor(s) and 5 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 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde?
The CAS number of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde is 136918-65-5.
What is the molecular formula of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde?
The molecular formula of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde is C21H22N2O3.
What is the molecular weight of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde?
The molecular weight of 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde is 350.16 g/mol.
Where can I buy 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde?
You can request a quote for 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(benzylamino)-7-(diethylamino)-2-oxo-2H-chromene-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.