4-(Butylamino)-2-oxochromene-3-carbaldehyde
TL;DR: 4-(Butylamino)-2-oxochromene-3-carbaldehyde (CAS 167866-49-1) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(butylamino)-2-oxochromene-3-carbaldehyde
Also Known As: 4-(butylamino)-2-oxochromene-3-carbaldehyde, 2H-1-Benzopyran-3-carboxaldehyde, 4-(butylamino)-2-oxo-, 4-(butylamino)-2-oxo-2H-chromene-3-carbaldehyde, 4-(butylamino)-2-oxo-chromene-3-carbaldehyde, AQ-349/42302563
Technical Specifications
| Molecular Formula | C14H15NO3 |
| Molecular Weight | 245.1052 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.1052 Da |
| Heavy Atoms | 18 |
| Complexity | 362.0 |
| SMILES | CCCCNC1=C(C(=O)OC2=CC=CC=C21)C=O |
| InChIKey | ZRDDDCSIZHRDIR-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Butylamino)-2-oxochromene-3-carbaldehyde
Property Insights of 4-(Butylamino)-2-oxochromene-3-carbaldehyde
The XLogP value of 3.1 indicates that 4-(Butylamino)-2-oxochromene-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 4-(Butylamino)-2-oxochromene-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Butylamino)-2-oxochromene-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
What is the CAS number of 4-(Butylamino)-2-oxochromene-3-carbaldehyde?
The CAS number of 4-(Butylamino)-2-oxochromene-3-carbaldehyde is 167866-49-1.
What is the molecular formula of 4-(Butylamino)-2-oxochromene-3-carbaldehyde?
The molecular formula of 4-(Butylamino)-2-oxochromene-3-carbaldehyde is C14H15NO3.
What is the molecular weight of 4-(Butylamino)-2-oxochromene-3-carbaldehyde?
The molecular weight of 4-(Butylamino)-2-oxochromene-3-carbaldehyde is 245.1052 g/mol.
Where can I buy 4-(Butylamino)-2-oxochromene-3-carbaldehyde?
You can request a quote for 4-(Butylamino)-2-oxochromene-3-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Butylamino)-2-oxochromene-3-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 4-(Butylamino)-2-oxochromene-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.