3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-
TL;DR: 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- (CAS 114479-12-8) is a chemical compound with molecular formula C18H19NO and molecular weight 265.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxy-5-methylphenyl)-3,3-dimethylindole
Also Known As: 2-(2-methoxy-5-methylphenyl)-3,3-dimethylindole, 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-3H-indole, 1,4-Cyclohexanedicarboxylic acid,monoethyl ester, AE-848/36047014
| Molecular Formula | C18H19NO |
|---|---|
| Molecular Weight | 265.15 g/mol |
| LogP | 4.41562 |
| Topological Polar Surface Area | 21.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.14667 |
| Heavy Atoms | 20 |
| Complexity | 698.31445 |
Chemical Identifiers
| CAS Number | 114479-12-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)C2=NC3=CC=CC=C3C2(C)C |
Product Overview
3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- (CAS 114479-12-8), with molecular formula C18H19NO and molecular weight 265.15 g/mol. IUPAC: 2-(2-methoxy-5-methylphenyl)-3,3-dimethylindole.
Chemical Property Profile of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-
Property Insights of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-
The XLogP value of 4.41562 indicates that 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.59 Ų, 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- has 0 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 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-?
The CAS number of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- is 114479-12-8.
What is the molecular formula of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-?
The molecular formula of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- is C18H19NO.
What is the molecular weight of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-?
The molecular weight of 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- is 265.15 g/mol.
Where can I buy 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-?
You can request a quote for 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Indole, 2-(2-methoxy-5-methylphenyl)-3,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.