4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide
TL;DR: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide (CAS 838868-93-2) is a chemical compound with molecular formula C23H26N4O and molecular weight 374.21 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-(3-imidazol-1-ylpropyl)benzamide
Also Known As: BAS 12272098, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide, 4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-yl-propyl)-benzamide, 4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-N-[3-(1H-imidazol-1-yl)propyl]benzamide
| Molecular Formula | C23H26N4O |
|---|---|
| Molecular Weight | 374.21 g/mol |
| LogP | 3.2615 |
| Topological Polar Surface Area | 50.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 374.21066 |
| Heavy Atoms | 28 |
| Complexity | 902.61646 |
Chemical Identifiers
| CAS Number | 838868-93-2 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NCCCN4C=CN=C4 |
Product Overview
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide (CAS 838868-93-2), with molecular formula C23H26N4O and molecular weight 374.21 g/mol. IUPAC: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide.
Chemical Property Profile of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide
Property Insights of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide
The XLogP value of 3.2615 indicates that 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.16 Ų, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide 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-(3-imidazol-1-ylpropyl)benzamide has 1 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 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide?
The CAS number of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide is 838868-93-2.
What is the molecular formula of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide?
The molecular formula of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide is C23H26N4O.
What is the molecular weight of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide?
The molecular weight of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide is 374.21 g/mol.
Where can I buy 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide?
You can request a quote for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide 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-(3-imidazol-1-ylpropyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(3-imidazol-1-ylpropyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.