![[[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate structure](/static/products/578/578002-43-4.png)
[[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate
TL;DR: [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate (CAS 578002-43-4) is a chemical compound with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate
Also Known As: [[amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate
| Molecular Formula | C16H14N2O4 |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 2.20102 |
| Topological Polar Surface Area | 83.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.09537 |
| Heavy Atoms | 22 |
| Complexity | 738.3111 |
Chemical Identifiers
| CAS Number | 578002-43-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=NOC(=O)C2=CC3=C(C=C2)OCO3)N |
Product Overview
[[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate (CAS 578002-43-4), with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol. IUPAC: [[amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate.
Chemical Property Profile of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate
Property Insights of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate
The XLogP value of 2.20102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate. The TPSA of 83.14 Ų falls within the moderate polarity range, balancing permeability and solubility for [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate. Following Lipinski's Rule of Five, [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate 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 [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate?
The CAS number of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate is 578002-43-4.
What is the molecular formula of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate?
The molecular formula of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate is C16H14N2O4.
What is the molecular weight of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate?
The molecular weight of [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate is 298.10 g/mol.
Where can I buy [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate?
You can request a quote for [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [[Amino-(4-methylphenyl)methylidene]amino] 1,3-benzodioxole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.