3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)
TL;DR: 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) (CAS 83658-48-4) is a chemical compound with molecular formula C19H23Cl2N3O2 and molecular weight 395.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[1-(4-nitrophenyl)-3,4-dihydroisoquinolin-3-yl]ethanamine;dihydrochloride
Also Known As: 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1), N,N-dimethyl-2-[1-(4-nitrophenyl)-3,4-dihydroisoquinolin-3-yl]ethanamine Dihydrochloride, N,N-Dimethyl-2-[1-(4-nitrophenyl)-3,4-dihydroisoquinolin-3-yl]ethan-1-amine--hydrogen chloride (1/2), RefChem:280206
| Molecular Formula | C19H23Cl2N3O2 |
|---|---|
| Molecular Weight | 395.12 g/mol |
| LogP | 4.1522 |
| Topological Polar Surface Area | 58.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.11673 |
| Heavy Atoms | 26 |
| Complexity | 776.60864 |
Chemical Identifiers
| CAS Number | 83658-48-4 |
|---|---|
| SMILES | CN(C)CCC1CC2=CC=CC=C2C(=N1)C3=CC=C(C=C3)[N+](=O)[O-].Cl.Cl |
Product Overview
3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) (CAS 83658-48-4), with molecular formula C19H23Cl2N3O2 and molecular weight 395.12 g/mol. IUPAC: N,N-dimethyl-2-[1-(4-nitrophenyl)-3,4-dihydroisoquinolin-3-yl]ethanamine;dihydrochloride.
Chemical Property Profile of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)
Property Insights of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)
The XLogP value of 4.1522 indicates that 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.74 Ų, 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) has 0 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 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)?
The CAS number of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) is 83658-48-4.
What is the molecular formula of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)?
The molecular formula of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) is C19H23Cl2N3O2.
What is the molecular weight of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)?
The molecular weight of 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) is 395.12 g/mol.
Where can I buy 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)?
You can request a quote for 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Isoquinolineethanamine, 3,4-dihydro-N,N-dimethyl-1-(4-nitrophenyl)-, hydrochloride, hydrate (1:2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.