Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride
TL;DR: Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride (CAS 22937-03-7) is a chemical compound with molecular formula C18H24Cl2N4O3 and molecular weight 414.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxypyrimidine;dihydrochloride
Also Known As: Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride, 4-Ethoxy-2-(4-piperonyl-1-piperazinyl)pyrimidine dihydrochloride, 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxypyrimidine dihydrochloride, 2-{4-[(2H-1,3-Benzodioxol-5-yl)methyl]piperazin-1-yl}-4-ethoxypyrimidine--hydrogen chloride (1/2), RefChem:377640
| Molecular Formula | C18H24Cl2N4O3 |
|---|---|
| Molecular Weight | 414.12 g/mol |
| LogP | 2.7698 |
| Topological Polar Surface Area | 60.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.12256 |
| Heavy Atoms | 27 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 22937-03-7 |
|---|---|
| SMILES | CCOC1=NC(=NC=C1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4.Cl.Cl |
| InChIKey | IQNGSIBHFYVZLC-UHFFFAOYSA-N |
Product Overview
Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride (CAS 22937-03-7), with molecular formula C18H24Cl2N4O3 and molecular weight 414.12 g/mol. IUPAC: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-ethoxypyrimidine;dihydrochloride.
Chemical Property Profile of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride
Property Insights of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride
The XLogP value of 2.7698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride. Following Lipinski's Rule of Five, Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride has 2 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 Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride?
The CAS number of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride is 22937-03-7.
What is the molecular formula of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride?
The molecular formula of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride is C18H24Cl2N4O3.
What is the molecular weight of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride?
The molecular weight of Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride is 414.12 g/mol.
Where can I buy Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride?
You can request a quote for Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 4-ethoxy-2-(4-piperonyl-1-piperazinyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.