4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde
TL;DR: 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde (CAS 5579-41-9) is a chemical compound with molecular formula C11H9NO3 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(methylamino)-2-oxochromene-3-carbaldehyde
Also Known As: 4-methylaminocoumarin-6-carbaldehyde, 4-(methylamino)-2-oxochromene-3-carbaldehyde, 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde, J2.201.103K, 2H-1-Benzopyran-3-carboxaldehyde, 4-(methylamino)-2-oxo-
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 1.6472 |
| Topological Polar Surface Area | 59.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 571.545 |
Chemical Identifiers
| CAS Number | 5579-41-9 |
|---|---|
| SMILES | CNC1=C(C(=O)OC2=CC=CC=C21)C=O |
Product Overview
4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde (CAS 5579-41-9), with molecular formula C11H9NO3 and molecular weight 203.06 g/mol. IUPAC: 4-(methylamino)-2-oxochromene-3-carbaldehyde.
Chemical Property Profile of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde
Property Insights of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde
The XLogP value of 1.6472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde. With a topological polar surface area (TPSA) of 59.31 Ų, 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde 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 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde?
The CAS number of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde is 5579-41-9.
What is the molecular formula of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde?
The molecular formula of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde is C11H9NO3.
What is the molecular weight of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde?
The molecular weight of 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde is 203.06 g/mol.
Where can I buy 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde?
You can request a quote for 4-(Methylamino)-2-oxo-2H-1-benzopyran-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-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.