3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one
TL;DR: 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one (CAS 335206-96-7) is a chemical compound with molecular formula C16H13NO3 and molecular weight 267.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-amino-2-methoxyphenyl)chromen-2-one
Also Known As: 3-(4-Amino-2-methoxy-phenyl)-chromen-2-one, 3-(4-amino-2-methoxyphenyl)-2H-chromen-2-one, 3-(4-amino-2-methoxyphenyl)chromen-2-one, BAS 02567080, 3-(4-amino-2-methoxy-phenyl)chromen-2-one
| Molecular Formula | C16H13NO3 |
|---|---|
| Molecular Weight | 267.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.08954 |
| Heavy Atoms | 20 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 335206-96-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)N)C2=CC3=CC=CC=C3OC2=O |
| InChIKey | ZNTKIICGKNNUHH-UHFFFAOYSA-N |
Product Overview
3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one (CAS 335206-96-7), with molecular formula C16H13NO3 and molecular weight 267.09 g/mol. IUPAC: 3-(4-amino-2-methoxyphenyl)chromen-2-one.
Chemical Property Profile of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one
Property Insights of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one. Following Lipinski's Rule of Five, 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one 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 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one?
The CAS number of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one is 335206-96-7.
What is the molecular formula of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one?
The molecular formula of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one is C16H13NO3.
What is the molecular weight of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one?
The molecular weight of 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one is 267.09 g/mol.
Where can I buy 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one?
You can request a quote for 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Amino-2-methoxyphenyl)-2H-1-benzopyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.