2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole
TL;DR: 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole (CAS 37831-71-3) is a chemical compound with molecular formula C13H16N2 and molecular weight 200.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole
Also Known As: ChemDiv1_000409, 2,6-Dimethyl-2,3,4,9-tetrahydro-1H-beta-carboline, BAS 01059879, BIM-0018697.P001, 2,6-dimethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole
| Molecular Formula | C13H16N2 |
|---|---|
| Molecular Weight | 200.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 19.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.13135 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 37831-71-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCN(C3)C |
| InChIKey | NSDIVZYSCVJIFL-UHFFFAOYSA-N |
Product Overview
2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole (CAS 37831-71-3), with molecular formula C13H16N2 and molecular weight 200.13 g/mol. IUPAC: 2,6-dimethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole.
Chemical Property Profile of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole
Property Insights of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole. With a topological polar surface area (TPSA) of 19.0 Ų, 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[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
Frequently Asked Questions
What is the CAS number of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole?
The CAS number of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole is 37831-71-3.
What is the molecular formula of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole?
The molecular formula of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole is C13H16N2.
What is the molecular weight of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole?
The molecular weight of 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole is 200.13 g/mol.
Where can I buy 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole?
You can request a quote for 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,9-Tetrahydro-2,6-dimethyl-1H-pyrido[3,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.