RefChem:1075500
TL;DR: RefChem:1075500 (CAS 91119-64-1) is a chemical compound with molecular formula C14H16N2O5 and molecular weight 292.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-1-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)ethylideneamino]oxyacetic acid
Also Known As: (((1-(4-Ethyl-3,4-dihydro-3-oxo-2H-1,4-benzoxazin-6-yl)ethylidene)amino)oxy)acetic acid, 4-Ethyl-2H-1,4-benzoxazin-3(4H)-one-6-acetoxime carboxymethyl ether, Acetic acid, (((1-(4-ethyl-3,4-dihydro-3-oxo-2H-1,4-benzoxazin-6-yl)ethylidene)amino)oxy)-, RefChem:1075500, BRN 4547172
| Molecular Formula | C14H16N2O5 |
|---|---|
| Molecular Weight | 292.11 g/mol |
| LogP | 1.2571 |
| Topological Polar Surface Area | 88.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.10593 |
| Heavy Atoms | 21 |
| Complexity | 597.0272 |
Chemical Identifiers
| CAS Number | 91119-64-1 |
|---|---|
| SMILES | CCN1C(=O)COC2=C1C=C(C=C2)/C(=N/OCC(=O)O)/C |
Product Overview
RefChem:1075500 (CAS 91119-64-1), with molecular formula C14H16N2O5 and molecular weight 292.11 g/mol. IUPAC: 2-[(E)-1-(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)ethylideneamino]oxyacetic acid.
Chemical Property Profile of RefChem:1075500
Property Insights of RefChem:1075500
The XLogP value of 1.2571 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1075500. The TPSA of 88.43 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1075500. Following Lipinski's Rule of Five, RefChem:1075500 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 RefChem:1075500?
The CAS number of RefChem:1075500 is 91119-64-1.
What is the molecular formula of RefChem:1075500?
The molecular formula of RefChem:1075500 is C14H16N2O5.
What is the molecular weight of RefChem:1075500?
The molecular weight of RefChem:1075500 is 292.11 g/mol.
Where can I buy RefChem:1075500?
You can request a quote for RefChem:1075500 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075500?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075500 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.