2-(4-Methoxyanilino)-3,1-benzoxazin-4-one
TL;DR: 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one (CAS 86672-55-1) is a chemical compound with molecular formula C15H12N2O3 and molecular weight 268.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyanilino)-3,1-benzoxazin-4-one
Also Known As: 2-(4-methoxyanilino)-3,1-benzoxazin-4-one, 2-(4-Methoxyanilino)-4H-3,1-benzoxazin-4-one, 2-[(4-methoxyphenyl)amino]-4H-3,1-Benzoxazin-4-one, 4H-3,1-Benzoxazin-4-one, 2-[(4-methoxyphenyl)amino]- (en)
| Molecular Formula | C15H12N2O3 |
|---|---|
| Molecular Weight | 268.08 g/mol |
| LogP | 2.9402 |
| Topological Polar Surface Area | 64.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.08478 |
| Heavy Atoms | 20 |
| Complexity | 794.0728 |
Chemical Identifiers
| CAS Number | 86672-55-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=O)O2 |
Product Overview
2-(4-Methoxyanilino)-3,1-benzoxazin-4-one (CAS 86672-55-1), with molecular formula C15H12N2O3 and molecular weight 268.08 g/mol. IUPAC: 2-(4-methoxyanilino)-3,1-benzoxazin-4-one.
Chemical Property Profile of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one
Property Insights of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one
The XLogP value of 2.9402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one. The TPSA of 64.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one. Following Lipinski's Rule of Five, 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one has 1 hydrogen bond donor(s) and 5 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-Methoxyanilino)-3,1-benzoxazin-4-one?
The CAS number of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one is 86672-55-1.
What is the molecular formula of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one?
The molecular formula of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one is C15H12N2O3.
What is the molecular weight of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one?
The molecular weight of 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one is 268.08 g/mol.
Where can I buy 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one?
You can request a quote for 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyanilino)-3,1-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.