![ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate structure](/static/products/6649/6649-92-9.webp)
ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate
TL;DR: ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate (CAS 6649-92-9) is a chemical compound with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate
Also Known As: NCI60_016441, Silane, trimethyl[(1-methylethenyl)oxy]-, ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate, ethyl 1H,2H,3H,4H,9H-pyrido[3,4-b]indole-1-carboxylate, ethyl 2,3,4,9-tetrahydro-1H-
| Molecular Formula | C14H16N2O2 |
|---|---|
| Molecular Weight | 244.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 54.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.12119 |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 6649-92-9 |
|---|---|
| SMILES | CCOC(=O)C1C2=C(CCN1)C3=CC=CC=C3N2 |
| InChIKey | VNHHPTIPSYSQIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate (CAS 6649-92-9), with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol. IUPAC: ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate.
Chemical Property Profile of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate
Property Insights of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate. With a topological polar surface area (TPSA) of 54.1 Ų, ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate has 2 hydrogen bond donor(s) and 3 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 ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate?
The CAS number of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate is 6649-92-9.
What is the molecular formula of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate?
The molecular formula of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate is C14H16N2O2.
What is the molecular weight of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate?
The molecular weight of ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate is 244.12 g/mol.
Where can I buy ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate?
You can request a quote for ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.