ChemDiv1_009293
TL;DR: ChemDiv1_009293 (CAS 6066-26-8) is a chemical compound with molecular formula C18H17NO5S and molecular weight 359.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-hydroxy-2-oxo-3-(2-oxo-2-thiophen-2-ylethyl)indol-1-yl]acetate
Also Known As: ChemDiv1_009293, BIM-0048835.P001, ethyl {3-hydroxy-2-oxo-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-indol-1-yl}acetate, ethyl {3-hydroxy-2-oxo-3-[2-oxo-2-(2-thienyl)ethyl]-2,3-dihydro-1H-indol-1-yl}acetate, ethyl 2-[3-hydroxy-2-oxo-3-(2-oxo-2-thiophen-2-ylethyl)indol-1-yl]acetate
| Molecular Formula | C18H17NO5S |
|---|---|
| Molecular Weight | 359.08 g/mol |
| LogP | 2.1184 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.08273 |
| Heavy Atoms | 25 |
| Complexity | 816.6337 |
Chemical Identifiers
| CAS Number | 6066-26-8 |
|---|---|
| SMILES | CCOC(=O)CN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC=CS3)O |
Product Overview
ChemDiv1_009293 (CAS 6066-26-8), with molecular formula C18H17NO5S and molecular weight 359.08 g/mol. IUPAC: ethyl 2-[3-hydroxy-2-oxo-3-(2-oxo-2-thiophen-2-ylethyl)indol-1-yl]acetate.
Chemical Property Profile of ChemDiv1_009293
Property Insights of ChemDiv1_009293
The XLogP value of 2.1184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_009293. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009293. Following Lipinski's Rule of Five, ChemDiv1_009293 has 1 hydrogen bond donor(s) and 6 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 ChemDiv1_009293?
The CAS number of ChemDiv1_009293 is 6066-26-8.
What is the molecular formula of ChemDiv1_009293?
The molecular formula of ChemDiv1_009293 is C18H17NO5S.
What is the molecular weight of ChemDiv1_009293?
The molecular weight of ChemDiv1_009293 is 359.08 g/mol.
Where can I buy ChemDiv1_009293?
You can request a quote for ChemDiv1_009293 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009293?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009293 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.