1,3-benzodioxole-5-carboximidamide, N'-hydroxy-
TL;DR: 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- (CAS 4720-72-3) is a chemical compound with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-hydroxy-1,3-benzodioxole-5-carboximidamide
Also Known As: 3,4-methylenedioxybenzamidoxime, 3,4-(Methylenedioxy)benzamidoxime, N'-hydroxy-1,3-benzodioxole-5-carboximidamide, 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-, N-Hydroxy-1,3-benzodioxole-5-carboximidamide
| Molecular Formula | C8H8N2O3 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 0.5098 |
| Topological Polar Surface Area | 77.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.0535 |
| Heavy Atoms | 13 |
| Complexity | 362.4068 |
Chemical Identifiers
| CAS Number | 4720-72-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C(=N\O)/N |
Product Overview
1,3-benzodioxole-5-carboximidamide, N'-hydroxy- (CAS 4720-72-3), with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol. IUPAC: N'-hydroxy-1,3-benzodioxole-5-carboximidamide.
Chemical Property Profile of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-
Property Insights of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-
The XLogP value of 0.5098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-. The TPSA of 77.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-. Following Lipinski's Rule of Five, 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- 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-benzodioxole-5-carboximidamide, N'-hydroxy-?
The CAS number of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- is 4720-72-3.
What is the molecular formula of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-?
The molecular formula of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- is C8H8N2O3.
What is the molecular weight of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-?
The molecular weight of 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- is 180.05 g/mol.
Where can I buy 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-?
You can request a quote for 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-benzodioxole-5-carboximidamide, N'-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-benzodioxole-5-carboximidamide, N'-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.