Coumarin, 7-methoxy-4-(4-pyridyl)-
TL;DR: Coumarin, 7-methoxy-4-(4-pyridyl)- (CAS 841-97-4) is a chemical compound with molecular formula C15H11NO3 and molecular weight 253.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-4-pyridin-4-ylchromen-2-one
Also Known As: Coumarin deriv. 33, 7-Methoxy-4-(4-pyridyl)coumarin, COUMARIN, 7-METHOXY-4-(4-PYRIDYL)-, 7-methoxy-4-(pyridin-4-yl)-2H-chromen-2-one, 7-METHOXY-4-(PYRIDIN-4-YL)COUMARIN
| Molecular Formula | C15H11NO3 |
|---|---|
| Molecular Weight | 253.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.0739 |
| Heavy Atoms | 19 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 841-97-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=NC=C3 |
| InChIKey | IWMJGRNPLOQFAS-UHFFFAOYSA-N |
Product Overview
Coumarin, 7-methoxy-4-(4-pyridyl)- (CAS 841-97-4), with molecular formula C15H11NO3 and molecular weight 253.07 g/mol. IUPAC: 7-methoxy-4-pyridin-4-ylchromen-2-one.
Chemical Property Profile of Coumarin, 7-methoxy-4-(4-pyridyl)-
Property Insights of Coumarin, 7-methoxy-4-(4-pyridyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coumarin, 7-methoxy-4-(4-pyridyl)-. With a topological polar surface area (TPSA) of 48.4 Ų, Coumarin, 7-methoxy-4-(4-pyridyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Coumarin, 7-methoxy-4-(4-pyridyl)- has 0 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 Coumarin, 7-methoxy-4-(4-pyridyl)-?
The CAS number of Coumarin, 7-methoxy-4-(4-pyridyl)- is 841-97-4.
What is the molecular formula of Coumarin, 7-methoxy-4-(4-pyridyl)-?
The molecular formula of Coumarin, 7-methoxy-4-(4-pyridyl)- is C15H11NO3.
What is the molecular weight of Coumarin, 7-methoxy-4-(4-pyridyl)-?
The molecular weight of Coumarin, 7-methoxy-4-(4-pyridyl)- is 253.07 g/mol.
Where can I buy Coumarin, 7-methoxy-4-(4-pyridyl)-?
You can request a quote for Coumarin, 7-methoxy-4-(4-pyridyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Coumarin, 7-methoxy-4-(4-pyridyl)-?
Yes, KEHONG BIO provides custom synthesis services for Coumarin, 7-methoxy-4-(4-pyridyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.