RefChem:1069717
TL;DR: RefChem:1069717 (CAS 34920-64-4) is a chemical compound with molecular formula C18H24ClNO2S and molecular weight 353.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-hydroxy-3-(4-hydroxyphenyl)propyl]-(3-phenylsulfanylpropyl)azanium chloride
Also Known As: Sid 178422, p-Hydroxy-alpha-(1-((3-(phenylthio)propyl)amino)ethyl)benzyl alcohol hydrochloride, 1-(p-Hydroxyphenyl)-2-(3'-phenylthiopropylamino)-1-propanol hydrochloride, Benzenemethanol, 4-hydroxy-alpha-(1-((3-(phenylthio)propyl)amino)ethyl)-, hydrochloride, Benzyl alcohol, p-hydroxy-alpha-(1-((3-(phenylthio)propyl)amino)ethyl)-, hydrochloride
| Molecular Formula | C18H24ClNO2S |
|---|---|
| Molecular Weight | 353.12 g/mol |
| LogP | -0.43 |
| Topological Polar Surface Area | 82.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 353.12164 |
| Heavy Atoms | 23 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 34920-64-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCCC[NH2+]CCC(C2=CC=C(C=C2)O)O.[Cl-] |
| InChIKey | PDPDJLXMNDIZMR-UHFFFAOYSA-N |
Product Overview
RefChem:1069717 (CAS 34920-64-4), with molecular formula C18H24ClNO2S and molecular weight 353.12 g/mol. IUPAC: [3-hydroxy-3-(4-hydroxyphenyl)propyl]-(3-phenylsulfanylpropyl)azanium chloride.
Chemical Property Profile of RefChem:1069717
Property Insights of RefChem:1069717
The XLogP value of -0.43 indicates that RefChem:1069717 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1069717. Following Lipinski's Rule of Five, RefChem:1069717 has 3 hydrogen bond donor(s) and 4 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:1069717?
The CAS number of RefChem:1069717 is 34920-64-4.
What is the molecular formula of RefChem:1069717?
The molecular formula of RefChem:1069717 is C18H24ClNO2S.
What is the molecular weight of RefChem:1069717?
The molecular weight of RefChem:1069717 is 353.12 g/mol.
Where can I buy RefChem:1069717?
You can request a quote for RefChem:1069717 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1069717?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1069717 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.