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Methyl 3-[(triphenylmethyl)sulfanyl]propanoate
TL;DR: Methyl 3-[(triphenylmethyl)sulfanyl]propanoate (CAS 500309-29-5) is a chemical compound with molecular formula C23H22O2S and molecular weight 362.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-tritylsulfanylpropanoate
Also Known As: methyl 3-tritylsulfanylpropanoate, methyl 3-[(triphenylmethyl)sulfanyl]propanoate, methyl 3-(tritylsulfanyl)propanoate, Triphenylmethyl-containing compound, 30, 3-(Tritylthio)propanoic acid methyl ester
| Molecular Formula | C23H22O2S |
|---|---|
| Molecular Weight | 362.13 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.13406 |
| Heavy Atoms | 26 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 500309-29-5 |
|---|---|
| SMILES | COC(=O)CCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | ZVXFXTVJLUNXBU-UHFFFAOYSA-N |
Product Overview
Methyl 3-[(triphenylmethyl)sulfanyl]propanoate (CAS 500309-29-5), with molecular formula C23H22O2S and molecular weight 362.13 g/mol. IUPAC: methyl 3-tritylsulfanylpropanoate.
Chemical Property Profile of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate
Property Insights of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate
The XLogP value of 5.4 indicates that Methyl 3-[(triphenylmethyl)sulfanyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, Methyl 3-[(triphenylmethyl)sulfanyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[(triphenylmethyl)sulfanyl]propanoate 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 Methyl 3-[(triphenylmethyl)sulfanyl]propanoate?
The CAS number of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate is 500309-29-5.
What is the molecular formula of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate?
The molecular formula of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate is C23H22O2S.
What is the molecular weight of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate?
The molecular weight of Methyl 3-[(triphenylmethyl)sulfanyl]propanoate is 362.13 g/mol.
Where can I buy Methyl 3-[(triphenylmethyl)sulfanyl]propanoate?
You can request a quote for Methyl 3-[(triphenylmethyl)sulfanyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(triphenylmethyl)sulfanyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(triphenylmethyl)sulfanyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.