TL;DR: 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride (CAS 1052532-77-0) is a chemical compound with molecular formula C19H23ClN2O and molecular weight 330.1499 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methylphenyl)propanamide;hydrochloride
Also Known As: 3-(3,4-Dihydro-1H-isoquinolin-2-yl)-N-p-tolyl-propionamide, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride, 3-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methylphenyl)propanamide hydrochloride
| Molecular Formula | C19H23ClN2O |
| Molecular Weight | 330.1499 g/mol |
| XLogP | 3.80372 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.1499 Da |
| Heavy Atoms | 23 |
| Complexity | 362.0 |
| SMILES | CC1=CC=C(C=C1)NC(=O)CCN2CCC3=CC=CC=C3C2.Cl |
| InChIKey | NBXMSDVBCARJHB-UHFFFAOYSA-N |
The XLogP value of 3.80372 indicates that 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride is 1052532-77-0.
The molecular formula of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride is C19H23ClN2O.
The molecular weight of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N-(p-tolyl)propanamide hydrochloride is 330.1499 g/mol.
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