1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine
TL;DR: 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine (CAS 72463-18-4) is a chemical compound with molecular formula C17H15N5O4 and molecular weight 353.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine
Also Known As: 1,2-bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine, N',2-Bis(1,3-benzodioxol-5-ylmethylene)hydrazinecarboximidohydrazide
| Molecular Formula | C17H15N5O4 |
|---|---|
| Molecular Weight | 353.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.1124 |
| Heavy Atoms | 26 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 72463-18-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=NNC(=NN=CC3=CC4=C(C=C3)OCO4)N |
| InChIKey | ASJXDSRAVCLDAQ-UHFFFAOYSA-N |
Product Overview
1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine (CAS 72463-18-4), with molecular formula C17H15N5O4 and molecular weight 353.11 g/mol. IUPAC: 1,2-bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine.
Chemical Property Profile of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine
Property Insights of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine. Following Lipinski's Rule of Five, 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine has 2 hydrogen bond donor(s) and 7 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 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine?
The CAS number of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine is 72463-18-4.
What is the molecular formula of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine?
The molecular formula of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine is C17H15N5O4.
What is the molecular weight of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine?
The molecular weight of 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine is 353.11 g/mol.
Where can I buy 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine?
You can request a quote for 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Bis(1,3-benzodioxol-5-ylmethylideneamino)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.