1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-
TL;DR: 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- (CAS 56643-77-7) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-ylmethyl)imidazole
Also Known As: Pyrimidin-N-dioxid, 1-(1,3-benzodioxol-5-ylmethyl)imidazole, 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-, 5-(1-Imidazolylmethyl)-1,3-benzodioxole, 1-(benzo[1,3]dioxol-5-ylmethyl)imidazole
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 1.6601 |
| Topological Polar Surface Area | 36.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 465.4451 |
Chemical Identifiers
| CAS Number | 56643-77-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CN3C=CN=C3 |
Product Overview
1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- (CAS 56643-77-7), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 1-(1,3-benzodioxol-5-ylmethyl)imidazole.
Chemical Property Profile of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-
Property Insights of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-
The XLogP value of 1.6601 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-. With a topological polar surface area (TPSA) of 36.28 Ų, 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- has 0 hydrogen bond donor(s) and 3 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 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-?
The CAS number of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- is 56643-77-7.
What is the molecular formula of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-?
The molecular formula of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- is C11H10N2O2.
What is the molecular weight of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-?
The molecular weight of 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- is 202.07 g/mol.
Where can I buy 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-?
You can request a quote for 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 1-(1,3-benzodioxol-5-ylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.