1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
TL;DR: 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline (CAS 22-13-9) is a chemical compound with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: DCNKZXPWASLNNH-UHFFFAOYSA-, J2.121.343H, 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline, 1-(3',5'-Dimethoxyphenyl)-1,2,3,4-tetrahydro-beta-carboline, 1-(3,5-Dimethoxyphenyl)-1,2,3,4-tetrahydro-beta-carboline
| Molecular Formula | C19H20N2O2 |
|---|---|
| Molecular Weight | 308.15 g/mol |
| LogP | 3.4202 |
| Topological Polar Surface Area | 46.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.15247 |
| Heavy Atoms | 23 |
| Complexity | 831.44696 |
Chemical Identifiers
| CAS Number | 22-13-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C2C3=C(CCN2)C4=CC=CC=C4N3)OC |
Product Overview
1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline (CAS 22-13-9), with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol. IUPAC: 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.
Chemical Property Profile of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
Property Insights of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
The XLogP value of 3.4202 indicates that 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.28 Ų, 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline 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 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
The CAS number of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is 22-13-9.
What is the molecular formula of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
The molecular formula of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is C19H20N2O2.
What is the molecular weight of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
The molecular weight of 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is 308.15 g/mol.
Where can I buy 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
You can request a quote for 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.