Maybridge1_004558
TL;DR: Maybridge1_004558 (CAS 175202-44-5) is a chemical compound with molecular formula C16H22O3S2 and molecular weight 326.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6,6-dimethyl-4-oxo-3-propan-2-ylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate
Also Known As: Maybridge1_004558, ethyl 3-(isopropylthio)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylate, BUTTPARK 94\04-50, 5737AD, ethyl 6,6-dimethyl-4-oxo-3-propan-2-ylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate
| Molecular Formula | C16H22O3S2 |
|---|---|
| Molecular Weight | 326.10 g/mol |
| LogP | 4.5804 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.10104 |
| Heavy Atoms | 21 |
| Complexity | 570.3224 |
Chemical Identifiers
| CAS Number | 175202-44-5 |
|---|---|
| SMILES | CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)SC(C)C)(C)C |
Product Overview
Maybridge1_004558 (CAS 175202-44-5), with molecular formula C16H22O3S2 and molecular weight 326.10 g/mol. IUPAC: ethyl 6,6-dimethyl-4-oxo-3-propan-2-ylsulfanyl-5,7-dihydro-2-benzothiophene-1-carboxylate.
Chemical Property Profile of Maybridge1_004558
Property Insights of Maybridge1_004558
The XLogP value of 4.5804 indicates that Maybridge1_004558 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Maybridge1_004558 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Maybridge1_004558 has 0 hydrogen bond donor(s) and 5 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 Maybridge1_004558?
The CAS number of Maybridge1_004558 is 175202-44-5.
What is the molecular formula of Maybridge1_004558?
The molecular formula of Maybridge1_004558 is C16H22O3S2.
What is the molecular weight of Maybridge1_004558?
The molecular weight of Maybridge1_004558 is 326.10 g/mol.
Where can I buy Maybridge1_004558?
You can request a quote for Maybridge1_004558 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Maybridge1_004558?
Yes, KEHONG BIO provides custom synthesis services for Maybridge1_004558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.