RefChem:117505
TL;DR: RefChem:117505 (CAS 68900-99-2) is a chemical compound with molecular formula C23H30N4O7S and molecular weight 506.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-benzoylpiperazin-1-yl)-2,5-di(propan-2-yloxy)benzenediazonium;hydrogen sulfate
Also Known As: Benzenediazonium, 4-(4-benzoyl-1-piperazinyl)-2,5-bis(1-methylethoxy)-, sulfate (1:1), 4-(N'-Benzoylpiperazino)-2,5-diisopropoxybenzenediazonium sulfate, 4-(4-benzoylpiperazin-1-yl)-2,5-bis(propan-2-yloxy)benzenediazonium hydrogen sulfate, 4-(4-Benzoylpiperazin-1-yl)-2,5-bis[(propan-2-yl)oxy]benzene-1-diazonium hydrogen sulfate, 4-(4-benzoylpiperazin-1-yl)-2,5-di(propan-2-yloxy)benzenediazonium; hydrogen sulfate
| Molecular Formula | C23H30N4O7S |
|---|---|
| Molecular Weight | 506.18 g/mol |
| LogP | 3.71 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.18353 |
| Heavy Atoms | 35 |
| Complexity | 679.0 |
Chemical Identifiers
| CAS Number | 68900-99-2 |
|---|---|
| SMILES | CC(C)OC1=CC(=C(C=C1[N+]#N)OC(C)C)N2CCN(CC2)C(=O)C3=CC=CC=C3.OS(=O)(=O)[O-] |
| InChIKey | CSTFYVIRYPFWIO-UHFFFAOYSA-M |
Product Overview
RefChem:117505 (CAS 68900-99-2), with molecular formula C23H30N4O7S and molecular weight 506.18 g/mol. IUPAC: 4-(4-benzoylpiperazin-1-yl)-2,5-di(propan-2-yloxy)benzenediazonium;hydrogen sulfate.
Chemical Property Profile of RefChem:117505
Property Insights of RefChem:117505
The XLogP value of 3.71 indicates that RefChem:117505 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting RefChem:117505 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:117505 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:117505?
The CAS number of RefChem:117505 is 68900-99-2.
What is the molecular formula of RefChem:117505?
The molecular formula of RefChem:117505 is C23H30N4O7S.
What is the molecular weight of RefChem:117505?
The molecular weight of RefChem:117505 is 506.18 g/mol.
Where can I buy RefChem:117505?
You can request a quote for RefChem:117505 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:117505?
Yes, KEHONG BIO provides custom synthesis services for RefChem:117505 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.