![1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole structure](/static/products/1150/115066-03-0.webp)
1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole
TL;DR: 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole (CAS 115066-03-0) is a chemical compound with molecular formula C16H21NO and molecular weight 243.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole
Also Known As: Decarboxy Etodolac, DecarboxyEtodolac, Etodolac EP Impurity J, Etodolac Impurity J, RAK 802
Technical Specifications
| Molecular Formula | C16H21NO |
| Molecular Weight | 243.16231 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 25.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.16231 Da |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
| SMILES | CCC1=C2C(=CC=C1)C3=C(N2)C(OCC3)(C)CC |
| InChIKey | IYMCQNNWNNRAQH-UHFFFAOYSA-N |
Chemical Property Profile of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole
Property Insights of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole
The XLogP value of 3.7 indicates that 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.0 Ų, 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole?
The CAS number of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole is 115066-03-0.
What is the molecular formula of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole?
The molecular formula of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole is C16H21NO.
What is the molecular weight of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole?
The molecular weight of 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole is 243.16231 g/mol.
Where can I buy 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole?
You can request a quote for 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole?
Yes, CoreyChem provides custom synthesis services for 1,8-diethyl-1-methyl-4,9-dihydro-3H-pyrano[3,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.