1-(3,4-Diethoxybenzylideneamino)guanidine
TL;DR: 1-(3,4-Diethoxybenzylideneamino)guanidine (CAS 5419-98-7) is a chemical compound with molecular formula C12H18N4O2 and molecular weight 250.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-diethoxyphenyl)methylideneamino]guanidine
Also Known As: 1-(3,4-Diethoxybenzylideneamino)guanidine, 2-[(3,4-diethoxyphenyl)methylideneamino]guanidine, 2-[(E)-(3,4-diethoxyphenyl)methylideneamino]guanidine
| Molecular Formula | C12H18N4O2 |
|---|---|
| Molecular Weight | 250.14 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 250.14297 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 5419-98-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C=NN=C(N)N)OCC |
| InChIKey | ZBAOBICPJQGYLN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3,4-Diethoxybenzylideneamino)guanidine (CAS 5419-98-7), with molecular formula C12H18N4O2 and molecular weight 250.14 g/mol. IUPAC: 2-[(3,4-diethoxyphenyl)methylideneamino]guanidine.
Chemical Property Profile of 1-(3,4-Diethoxybenzylideneamino)guanidine
Property Insights of 1-(3,4-Diethoxybenzylideneamino)guanidine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Diethoxybenzylideneamino)guanidine. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Diethoxybenzylideneamino)guanidine. Following Lipinski's Rule of Five, 1-(3,4-Diethoxybenzylideneamino)guanidine has 2 hydrogen bond donor(s) and 4 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 1-(3,4-Diethoxybenzylideneamino)guanidine?
The CAS number of 1-(3,4-Diethoxybenzylideneamino)guanidine is 5419-98-7.
What is the molecular formula of 1-(3,4-Diethoxybenzylideneamino)guanidine?
The molecular formula of 1-(3,4-Diethoxybenzylideneamino)guanidine is C12H18N4O2.
What is the molecular weight of 1-(3,4-Diethoxybenzylideneamino)guanidine?
The molecular weight of 1-(3,4-Diethoxybenzylideneamino)guanidine is 250.14 g/mol.
Where can I buy 1-(3,4-Diethoxybenzylideneamino)guanidine?
You can request a quote for 1-(3,4-Diethoxybenzylideneamino)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Diethoxybenzylideneamino)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Diethoxybenzylideneamino)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.