2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide
TL;DR: 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide (CAS 387830-91-3) is a chemical compound with molecular formula C21H15N3O5 and molecular weight 389.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide
Also Known As: BAS 06899857, 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide, 2-(4-(2-amino-3-cyano-5-oxo-4,5-dihydropyrano[3,2-c]chromen-4-yl)phenoxy)acetamide, 2-[4-(2-Amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromen-4-yl)-phenoxy]-acetamide, 2-[4-(2-amino-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide
| Molecular Formula | C21H15N3O5 |
|---|---|
| Molecular Weight | 389.10 g/mol |
| LogP | 1.87528 |
| Topological Polar Surface Area | 141.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.10117 |
| Heavy Atoms | 29 |
| Complexity | 1252.0321 |
Chemical Identifiers
| CAS Number | 387830-91-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C(C(=C(O3)N)C#N)C4=CC=C(C=C4)OCC(=O)N)C(=O)O2 |
Product Overview
2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide (CAS 387830-91-3), with molecular formula C21H15N3O5 and molecular weight 389.10 g/mol. IUPAC: 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide.
Chemical Property Profile of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide
Property Insights of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide
The XLogP value of 1.87528 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide. The TPSA of 141.57 Ų indicates high polarity, suggesting 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide has 2 hydrogen bond donor(s) and 7 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 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide?
The CAS number of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide is 387830-91-3.
What is the molecular formula of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide?
The molecular formula of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide is C21H15N3O5.
What is the molecular weight of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide?
The molecular weight of 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide is 389.10 g/mol.
Where can I buy 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide?
You can request a quote for 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)phenoxy]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.