RefChem:371845
TL;DR: RefChem:371845 (CAS 3398-26-3) is a chemical compound with molecular formula C22H25ClN2O5 and molecular weight 432.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone;hydrochloride
Also Known As: Piperazine, 1-(1,4-benzodioxan-6-ylcarbonyl)-4-(1,4-benzodioxan-6-ylmethyl)-, hydrochloride, 1-(1,4-Benzodioxan-6-ylcarbonyl)-4-(1,4-benzodioxan-6-ylmethyl)piperazine hydrochloride, (2,3-Dihydro-1,4-benzodioxin-6-yl){4-[(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]piperazin-1-yl}methanone--hydrogen chloride (1/1), 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone hydrochloride, Piperazine, 1-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbonyl]-4-[(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-, monohydrochloride
| Molecular Formula | C22H25ClN2O5 |
|---|---|
| Molecular Weight | 432.15 g/mol |
| LogP | 2.6088 |
| Topological Polar Surface Area | 60.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 432.1452 |
| Heavy Atoms | 30 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 3398-26-3 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C(=O)C4=CC5=C(C=C4)OCCO5.Cl |
| InChIKey | VUJGYZDZRTUFLY-UHFFFAOYSA-N |
Product Overview
RefChem:371845 (CAS 3398-26-3), with molecular formula C22H25ClN2O5 and molecular weight 432.15 g/mol. IUPAC: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone;hydrochloride.
Chemical Property Profile of RefChem:371845
Property Insights of RefChem:371845
The XLogP value of 2.6088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:371845. The TPSA of 60.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:371845. Following Lipinski's Rule of Five, RefChem:371845 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 RefChem:371845?
The CAS number of RefChem:371845 is 3398-26-3.
What is the molecular formula of RefChem:371845?
The molecular formula of RefChem:371845 is C22H25ClN2O5.
What is the molecular weight of RefChem:371845?
The molecular weight of RefChem:371845 is 432.15 g/mol.
Where can I buy RefChem:371845?
You can request a quote for RefChem:371845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371845?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.