2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one
TL;DR: 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one (CAS 843628-76-2) is a chemical compound with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Also Known As: 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one, 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone, BAS 10142286, 2-Chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)-ethanone
| Molecular Formula | C12H12ClNO2 |
|---|---|
| Molecular Weight | 237.06 g/mol |
| LogP | 2.90642 |
| Topological Polar Surface Area | 42.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.05565 |
| Heavy Atoms | 16 |
| Complexity | 545.1875 |
Chemical Identifiers
| CAS Number | 843628-76-2 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)OC)C(=O)CCl |
Product Overview
2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one (CAS 843628-76-2), with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol. IUPAC: 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone.
Chemical Property Profile of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one
Property Insights of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one
The XLogP value of 2.90642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one. With a topological polar surface area (TPSA) of 42.09 Ų, 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one has 1 hydrogen bond donor(s) and 2 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 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one?
The CAS number of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one is 843628-76-2.
What is the molecular formula of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one?
The molecular formula of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one is C12H12ClNO2.
What is the molecular weight of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one?
The molecular weight of 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one is 237.06 g/mol.
Where can I buy 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one?
You can request a quote for 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-1-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.