3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide
TL;DR: 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide (CAS 120130-45-2) is a chemical compound with molecular formula C16H17IN2 and molecular weight 364.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-1,4-dihydroisoquinolin-3-amine;hydroiodide
Also Known As: 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide, N-Benzyl-1,4-dihydro-3-isochinolinamin hydroiodid, N-Benzyl-1,4-dihydro-3-isochinolinamin hydroiodid [German], 1,4-Dihydro-N-(phenylmethyl)-3(2H)-isoquinolinimine hydriodide, 3-Isoquinolinamine, 1,4-dihydro-N-(phenylmethyl)-, monohydriodide
| Molecular Formula | C16H17IN2 |
|---|---|
| Molecular Weight | 364.04 g/mol |
| LogP | 3.549 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 364.04364 |
| Heavy Atoms | 19 |
| Complexity | 563.97144 |
Chemical Identifiers
| CAS Number | 120130-45-2 |
|---|---|
| SMILES | C1C2=CC=CC=C2CN=C1NCC3=CC=CC=C3.I |
Product Overview
3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide (CAS 120130-45-2), with molecular formula C16H17IN2 and molecular weight 364.04 g/mol. IUPAC: N-benzyl-1,4-dihydroisoquinolin-3-amine;hydroiodide.
Chemical Property Profile of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide
Property Insights of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide
The XLogP value of 3.549 indicates that 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.39 Ų, 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide has 1 hydrogen bond donor(s) and 2 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(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide?
The CAS number of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide is 120130-45-2.
What is the molecular formula of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide?
The molecular formula of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide is C16H17IN2.
What is the molecular weight of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide?
The molecular weight of 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide is 364.04 g/mol.
Where can I buy 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide?
You can request a quote for 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Isoquinolinimine, 1,4-dihydro-N-(phenylmethyl)-, hydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.