RefChem:1058519
TL;DR: RefChem:1058519 (CAS 3380-74-3) is a chemical compound with molecular formula C19H21ClN2O2 and molecular weight 344.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
Also Known As: 1-(3,4-Dimethoxyphenyl)tetrahydronorharman hydrochloride, 9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-1-(3,4-dimethoxyphenyl)-, hydrochloride, 1-(3,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride, 1-(3,4-Dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole--hydrogen chloride (1/1), 1H-Pyrido(3,4-b)indole, 1-(3,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-, hydrochloride (1:1)
| Molecular Formula | C19H21ClN2O2 |
|---|---|
| Molecular Weight | 344.13 g/mol |
| LogP | 3.842 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.12915 |
| Heavy Atoms | 24 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 3380-74-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C3=C(CCN2)C4=CC=CC=C4N3)OC.Cl |
| InChIKey | YWINRDGIFIQPAA-UHFFFAOYSA-N |
Product Overview
RefChem:1058519 (CAS 3380-74-3), with molecular formula C19H21ClN2O2 and molecular weight 344.13 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride.
Chemical Property Profile of RefChem:1058519
Property Insights of RefChem:1058519
The XLogP value of 3.842 indicates that RefChem:1058519 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.3 Ų, RefChem:1058519 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058519 has 3 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 RefChem:1058519?
The CAS number of RefChem:1058519 is 3380-74-3.
What is the molecular formula of RefChem:1058519?
The molecular formula of RefChem:1058519 is C19H21ClN2O2.
What is the molecular weight of RefChem:1058519?
The molecular weight of RefChem:1058519 is 344.13 g/mol.
Where can I buy RefChem:1058519?
You can request a quote for RefChem:1058519 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058519?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058519 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.