Cholest-5-en-3beta-yl toluene-p-sulphonate
TL;DR: Cholest-5-en-3beta-yl toluene-p-sulphonate (CAS 1182-65-6) is a chemical compound with molecular formula C34H52O3S and molecular weight 540.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,17R)-1,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,7,8,9,10,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] 4-methylbenzenesulfonate
Also Known As: Cholesteryl tosylate, Cholesterol 3-tosylate, 3beta-Tosyloxycholest-5-ene, Cholesteryl p-toluenesulfonate, CHOLESTERYL 3-TOSYLATE
| Molecular Formula | C34H52O3S |
|---|---|
| Molecular Weight | 540.36 g/mol |
| LogP | 10.5 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 540.3637 |
| Heavy Atoms | 38 |
| Complexity | 939.0 |
Chemical Identifiers
| CAS Number | 1182-65-6 |
|---|---|
| SMILES | CC1C[C@@H](CC2=CCC3C(C12)CCC4(C3CC[C@@H]4C(C)CCCC(C)C)C)OS(=O)(=O)C5=CC=C(C=C5)C |
| InChIKey | IPUGVCLRKFAZKZ-OCZIXGCJSA-N |
Product Overview
Cholest-5-en-3beta-yl toluene-p-sulphonate (CAS 1182-65-6), with molecular formula C34H52O3S and molecular weight 540.36 g/mol. IUPAC: [(3S,17R)-1,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,7,8,9,10,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] 4-methylbenzenesulfonate.
Chemical Property Profile of Cholest-5-en-3beta-yl toluene-p-sulphonate
Property Insights of Cholest-5-en-3beta-yl toluene-p-sulphonate
The XLogP value of 10.5 indicates that Cholest-5-en-3beta-yl toluene-p-sulphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, Cholest-5-en-3beta-yl toluene-p-sulphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholest-5-en-3beta-yl toluene-p-sulphonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cholest-5-en-3beta-yl toluene-p-sulphonate?
The CAS number of Cholest-5-en-3beta-yl toluene-p-sulphonate is 1182-65-6.
What is the molecular formula of Cholest-5-en-3beta-yl toluene-p-sulphonate?
The molecular formula of Cholest-5-en-3beta-yl toluene-p-sulphonate is C34H52O3S.
What is the molecular weight of Cholest-5-en-3beta-yl toluene-p-sulphonate?
The molecular weight of Cholest-5-en-3beta-yl toluene-p-sulphonate is 540.36 g/mol.
Where can I buy Cholest-5-en-3beta-yl toluene-p-sulphonate?
You can request a quote for Cholest-5-en-3beta-yl toluene-p-sulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cholest-5-en-3beta-yl toluene-p-sulphonate?
Yes, KEHONG BIO provides custom synthesis services for Cholest-5-en-3beta-yl toluene-p-sulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.