2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate
TL;DR: 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate (CAS 87135-04-4) is a chemical compound with molecular formula C15H17N3O6 and molecular weight 335.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-but-2-enedioic acid;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5-dihydro-1H-imidazol-2-amine
Also Known As: 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate, RX 801074, 1H-Imidazol-2-amine, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5-dihydro-, (Z)-2-butenedioate (1:1), (Z)-but-2-enedioic acid;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5-dihydro-1H-imidazol-2-amine, (Z)-but-2-enedioic acid; N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5-dihydro-1H-imidazol-2-amine
| Molecular Formula | C15H17N3O6 |
|---|---|
| Molecular Weight | 335.11 g/mol |
| LogP | 0.5407 |
| Topological Polar Surface Area | 129.48 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.11172 |
| Heavy Atoms | 24 |
| Complexity | 655.1733 |
Chemical Identifiers
| CAS Number | 87135-04-4 |
|---|---|
| SMILES | C1CN=C(N1)NC2=CC3=C(C=C2)OCCO3.C(=C\C(=O)O)\C(=O)O |
Product Overview
2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate (CAS 87135-04-4), with molecular formula C15H17N3O6 and molecular weight 335.11 g/mol. IUPAC: (Z)-but-2-enedioic acid;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,5-dihydro-1H-imidazol-2-amine.
Chemical Property Profile of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate
Property Insights of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate
The XLogP value of 0.5407 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate. The TPSA of 129.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate. Following Lipinski's Rule of Five, 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate has 4 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 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate?
The CAS number of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate is 87135-04-4.
What is the molecular formula of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate?
The molecular formula of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate is C15H17N3O6.
What is the molecular weight of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate?
The molecular weight of 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate is 335.11 g/mol.
Where can I buy 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate?
You can request a quote for 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate?
Yes, KEHONG BIO provides custom synthesis services for 2-(6-(1,4-Benzodioxanyl)amino)imidazoline maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.