Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)
TL;DR: Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) (CAS 17228-45-4) is a chemical compound with molecular formula C10H15N3O6S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[amino(azaniumylidene)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]azanium sulfate
Also Known As: 1-(2-(1,3-Benzodioxol-5-yl)ethyl)guanidine sulfate (2:1), 1-(3,4-(Methylenedioxy)phenethyl)guanidine sulfate (2:1), C10-H13-N3-O2.1/2H2-O4-S, GUANIDINE, 1-(3,4-(METHYLENEDIOXY)PHENETHYL)-, SULFATE (2:1), [Amino(azaniumylidene)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]azaniumsulfate
| Molecular Formula | C10H15N3O6S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | -3.74 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.06815 |
| Heavy Atoms | 20 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 17228-45-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CC[NH2+]C(=[NH2+])N.[O-]S(=O)(=O)[O-] |
| InChIKey | KGVVPJHWSMADBD-UHFFFAOYSA-N |
Product Overview
Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) (CAS 17228-45-4), with molecular formula C10H15N3O6S and molecular weight 305.07 g/mol. IUPAC: [amino(azaniumylidene)methyl]-[2-(1,3-benzodioxol-5-yl)ethyl]azanium sulfate.
Chemical Property Profile of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)
Property Insights of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)
The XLogP value of -3.74 indicates that Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) has 3 hydrogen bond donor(s) and 6 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 Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)?
The CAS number of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) is 17228-45-4.
What is the molecular formula of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)?
The molecular formula of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) is C10H15N3O6S.
What is the molecular weight of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)?
The molecular weight of Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) is 305.07 g/mol.
Where can I buy Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)?
You can request a quote for Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, 1-(3,4-(methylenedioxy)phenethyl)-, sulfate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.