埃索美拉唑鎂
TL;DR: 埃索美拉唑鎂 (CAS 138530-94-6) is a chemical compound with molecular formula CCSC1=CC=C(C=C1)C and molecular weight 152.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
埃索美拉唑鎂
1-ethylsulfanyl-4-methylbenzene
Also Known As: 4-(Ethylthio)toluene, Ethyl p-tolyl sulfide, Ethyl(p-tolyl)sulfane, Sulfide, ethyl p-tolyl, p-Cresyl ethyl sulfide
| Molecular Formula | CCSC1=CC=C(C=C1)C |
|---|---|
| Molecular Weight | 152.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.06598 |
| Heavy Atoms | 10 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 138530-94-6 |
|---|---|
| SMILES | CCSC1=CC=C(C=C1)C |
| InChIKey | TXMFDSUMJLQLGB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
埃索美拉唑鎂 (CAS 138530-94-6), with molecular formula CCSC1=CC=C(C=C1)C and molecular weight 152.07 g/mol. IUPAC: 1-ethylsulfanyl-4-methylbenzene.
Chemical Property Profile of 埃索美拉唑鎂
Property Insights of 埃索美拉唑鎂
The XLogP value of 3.2 indicates that 埃索美拉唑鎂 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 埃索美拉唑鎂 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 埃索美拉唑鎂 has 0 hydrogen bond donor(s) and 1 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 埃索美拉唑鎂?
The CAS number of 埃索美拉唑鎂 is 138530-94-6.
What is the molecular formula of 埃索美拉唑鎂?
The molecular formula of 埃索美拉唑鎂 is CCSC1=CC=C(C=C1)C.
What is the molecular weight of 埃索美拉唑鎂?
The molecular weight of 埃索美拉唑鎂 is 152.07 g/mol.
Where can I buy 埃索美拉唑鎂?
You can request a quote for 埃索美拉唑鎂 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 埃索美拉唑鎂?
Yes, KEHONG BIO provides custom synthesis services for 埃索美拉唑鎂 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.