RefChem:313626
TL;DR: RefChem:313626 (CAS 3380-76-5) is a chemical compound with molecular formula C20H23ClN2O3 and molecular weight 374.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
Also Known As: 1-(3,4,5-Trimethoxyphenyl)-1,2,3,4-tetrahydronorharman hydrochloride, 9H-Pyrido(3,4-6)indole, 1,2,3,4-tetrahydro-1-(3,4,5-methoxyphenyl)-, hydrochloride, 1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride, 1-(3,4,5-Trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1), RefChem:313626
| Molecular Formula | C20H23ClN2O3 |
|---|---|
| Molecular Weight | 374.14 g/mol |
| LogP | 3.8506 |
| Topological Polar Surface Area | 55.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.1397 |
| Heavy Atoms | 26 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 3380-76-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2C3=C(CCN2)C4=CC=CC=C4N3.Cl |
| InChIKey | GNGITEBMIOBPMF-UHFFFAOYSA-N |
Product Overview
RefChem:313626 (CAS 3380-76-5), with molecular formula C20H23ClN2O3 and molecular weight 374.14 g/mol. IUPAC: 1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride.
Chemical Property Profile of RefChem:313626
Property Insights of RefChem:313626
The XLogP value of 3.8506 indicates that RefChem:313626 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.5 Ų, RefChem:313626 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:313626 has 3 hydrogen bond donor(s) and 4 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 RefChem:313626?
The CAS number of RefChem:313626 is 3380-76-5.
What is the molecular formula of RefChem:313626?
The molecular formula of RefChem:313626 is C20H23ClN2O3.
What is the molecular weight of RefChem:313626?
The molecular weight of RefChem:313626 is 374.14 g/mol.
Where can I buy RefChem:313626?
You can request a quote for RefChem:313626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:313626?
Yes, KEHONG BIO provides custom synthesis services for RefChem:313626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.