4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate
TL;DR: 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate (CAS 35748-35-7) is a chemical compound with molecular formula C16H12N2O6 and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-amino-3-oxophenoxazine-4,6-dicarboxylate
Also Known As: 2-Amino-3-oxo-3H-phenoxazine-4,6-dicarboxylic acid dimethyl ester, Phenoxazine-4,6-dicarboxylic acid der., Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate, dimethyl 2-amino-3-oxophenoxazine-4,6-dicarboxylate, 3H-Phenoxazine-4,6-dicarboxylic acid, 2-amino-3-oxo-, dimethyl ester
| Molecular Formula | C16H12N2O6 |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.06955 |
| Heavy Atoms | 24 |
| Complexity | 705.0 |
Chemical Identifiers
| CAS Number | 35748-35-7 |
|---|---|
| SMILES | COC(=O)C1=C2C(=CC=C1)N=C3C=C(C(=O)C(=C3O2)C(=O)OC)N |
| InChIKey | VDXGQNZVNDDQND-UHFFFAOYSA-N |
Product Overview
4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate (CAS 35748-35-7), with molecular formula C16H12N2O6 and molecular weight 328.07 g/mol. IUPAC: dimethyl 2-amino-3-oxophenoxazine-4,6-dicarboxylate.
Chemical Property Profile of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate
Property Insights of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate. Following Lipinski's Rule of Five, 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate has 1 hydrogen bond donor(s) and 8 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 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate?
The CAS number of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate is 35748-35-7.
What is the molecular formula of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate?
The molecular formula of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate is C16H12N2O6.
What is the molecular weight of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate?
The molecular weight of 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate is 328.07 g/mol.
Where can I buy 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate?
You can request a quote for 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dimethyl 2-amino-3-oxo-3H-phenoxazine-4,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.