4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide
TL;DR: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide (CAS 333358-13-7) is a chemical compound with molecular formula C23H22N2O and molecular weight 342.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide
Also Known As: BAS 00794512, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide, 4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-N-phenyl-benzamide, 4-(3,4-dihydro-2(1H)-isoquinolinylmethyl)-N-phenylbenzamide, 4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-N-phenylbenzamide
| Molecular Formula | C23H22N2O |
|---|---|
| Molecular Weight | 342.17 g/mol |
| LogP | 4.4972 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.17322 |
| Heavy Atoms | 26 |
| Complexity | 887.59607 |
Chemical Identifiers
| CAS Number | 333358-13-7 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4 |
Product Overview
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide (CAS 333358-13-7), with molecular formula C23H22N2O and molecular weight 342.17 g/mol. IUPAC: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide.
Chemical Property Profile of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide
Property Insights of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide
The XLogP value of 4.4972 indicates that 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide 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 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide?
The CAS number of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide is 333358-13-7.
What is the molecular formula of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide?
The molecular formula of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide is C23H22N2O.
What is the molecular weight of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide?
The molecular weight of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide is 342.17 g/mol.
Where can I buy 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide?
You can request a quote for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-phenylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.