1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-
TL;DR: 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- (CAS 80987-72-0) is a chemical compound with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-yl)-N-methyl-1,3,4-oxadiazol-2-amine
Also Known As: 5-(1,3-Benzodioxol-5-yl)-N-methyl-1,3,4-oxadiazol-2-amine, 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-, 5-(2H-1,3-Benzodioxol-5-yl)-N-methyl-1,3,4-oxadiazol-2-amine, RefChem:216866
| Molecular Formula | C10H9N3O3 |
|---|---|
| Molecular Weight | 219.06 g/mol |
| LogP | 1.507 |
| Topological Polar Surface Area | 69.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.06439 |
| Heavy Atoms | 16 |
| Complexity | 523.77783 |
Chemical Identifiers
| CAS Number | 80987-72-0 |
|---|---|
| SMILES | CNC1=NN=C(O1)C2=CC3=C(C=C2)OCO3 |
Product Overview
1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- (CAS 80987-72-0), with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol. IUPAC: 5-(1,3-benzodioxol-5-yl)-N-methyl-1,3,4-oxadiazol-2-amine.
Chemical Property Profile of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-
Property Insights of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-
The XLogP value of 1.507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-. The TPSA of 69.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-. Following Lipinski's Rule of Five, 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- has 1 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 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-?
The CAS number of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- is 80987-72-0.
What is the molecular formula of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-?
The molecular formula of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- is C10H9N3O3.
What is the molecular weight of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-?
The molecular weight of 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- is 219.06 g/mol.
Where can I buy 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-?
You can request a quote for 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- 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-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-N-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.