3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide
TL;DR: 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide (CAS 425625-55-4) is a chemical compound with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[amino-(3,4-dimethoxyphenyl)methylidene]amino] benzoate
Also Known As: N'-(benzoyloxy)-3,4-dimethoxybenzenecarboximidamide, 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide, (Z)-[AMINO(3,4-DIMETHOXYPHENYL)METHYLIDENE]AMINO BENZOATE
| Molecular Formula | C16H16N2O4 |
|---|---|
| Molecular Weight | 300.11 g/mol |
| LogP | 2.1811 |
| Topological Polar Surface Area | 83.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.111 |
| Heavy Atoms | 22 |
| Complexity | 683.8001 |
Chemical Identifiers
| CAS Number | 425625-55-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=N/OC(=O)C2=CC=CC=C2)/N)OC |
Product Overview
3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide (CAS 425625-55-4), with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol. IUPAC: [(Z)-[amino-(3,4-dimethoxyphenyl)methylidene]amino] benzoate.
Chemical Property Profile of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide
Property Insights of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide
The XLogP value of 2.1811 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide. The TPSA of 83.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide. Following Lipinski's Rule of Five, 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide 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 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide?
The CAS number of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide is 425625-55-4.
What is the molecular formula of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide?
The molecular formula of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide is C16H16N2O4.
What is the molecular weight of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide?
The molecular weight of 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide is 300.11 g/mol.
Where can I buy 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide?
You can request a quote for 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethoxy-N'-[(phenylcarbonyl)oxy]benzenecarboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.