(S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
TL;DR: (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 23844-21-5) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: Methtryptoline, (S)-(-)-Tetrahydroharman, (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, (-)-1,2,3,4-Tetrahydroharman, (S)-1-methyl-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 27.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 23844-21-5 |
|---|---|
| SMILES | C[C@H]1C2=C(CCN1)C3=CC=CC=C3N2 |
| InChIKey | LPIJOZBIVDCQTE-QMMMGPOBSA-N |
Product Overview
(S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CAS 23844-21-5), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: (1S)-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.
Chemical Property Profile of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Property Insights of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole. With a topological polar surface area (TPSA) of 27.8 Ų, (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole has 2 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 (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The CAS number of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 23844-21-5.
What is the molecular formula of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular formula of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C12H14N2.
What is the molecular weight of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
The molecular weight of (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is 186.12 g/mol.
Where can I buy (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
You can request a quote for (S)-1-Methyl-2,3,4,9-tetrahydro-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 (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for (S)-1-Methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.