2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-
TL;DR: 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- (CAS 75497-74-4) is a chemical compound with molecular formula C15H17NO3 and molecular weight 259.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-7-(diethylamino)chromen-2-one
Also Known As: 3-acetyl-7-(diethylamino)-2H-chromen-2-one, 3-acetyl-7-diethylaminocoumarin, 3-acetyl-7-(diethylamino)coumarin, 3-acetyl-7-(diethylamino)chromen-2-one, 3-Acetyl-7-diethylamino-chromen-2-one
| Molecular Formula | C15H17NO3 |
|---|---|
| Molecular Weight | 259.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.12085 |
| Heavy Atoms | 19 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 75497-74-4 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C |
| InChIKey | JQYDECSZBZCKFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- (CAS 75497-74-4), with molecular formula C15H17NO3 and molecular weight 259.12 g/mol. IUPAC: 3-acetyl-7-(diethylamino)chromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-
Property Insights of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-. With a topological polar surface area (TPSA) of 46.6 Ų, 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- 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 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-?
The CAS number of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- is 75497-74-4.
What is the molecular formula of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-?
The molecular formula of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- is C15H17NO3.
What is the molecular weight of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-?
The molecular weight of 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- is 259.12 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-?
You can request a quote for 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 3-acetyl-7-(diethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.