1-(2-Nitrophenyl)-3,4-dihydroisoquinoline
TL;DR: 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline (CAS 19007-73-9) is a chemical compound with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-nitrophenyl)-3,4-dihydroisoquinoline
Also Known As: 1-(2-nitrophenyl)-3,4-dihydroisoquinoline, J1.236.344C, Isoquinoline, 3,4-dihydro-1-(2-nitrophenyl)-, A4075/0173631, RefChem:223808
| Molecular Formula | C15H12N2O2 |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 2.9883 |
| Topological Polar Surface Area | 55.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.08987 |
| Heavy Atoms | 19 |
| Complexity | 677.3507 |
Chemical Identifiers
| CAS Number | 19007-73-9 |
|---|---|
| SMILES | C1CN=C(C2=CC=CC=C21)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
1-(2-Nitrophenyl)-3,4-dihydroisoquinoline (CAS 19007-73-9), with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol. IUPAC: 1-(2-nitrophenyl)-3,4-dihydroisoquinoline.
Chemical Property Profile of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline
Property Insights of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline
The XLogP value of 2.9883 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline. With a topological polar surface area (TPSA) of 55.5 Ų, 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline has 0 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-(2-Nitrophenyl)-3,4-dihydroisoquinoline?
The CAS number of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline is 19007-73-9.
What is the molecular formula of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline?
The molecular formula of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline is C15H12N2O2.
What is the molecular weight of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline?
The molecular weight of 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline is 252.09 g/mol.
Where can I buy 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline?
You can request a quote for 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Nitrophenyl)-3,4-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.