TL;DR: 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde (CAS 124867-50-1) is a chemical compound with molecular formula C15H21NO5 and molecular weight 295.14197 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
Also Known As: 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde, (N-Formyl-5,7,8-trimethoxy-6-methyl-1,2,3,4-tetrahydro-1-isoquinolyl)methanol, 2(1H)-Isoquinolinecarboxaldehyde, 3,4-dihydro-1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-, 2(1H)-Isoquinolinecarboxaldehyde,3,4-dihydro-1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-, 1-(HYDROXYMETHYL)-5,7,8-TRIMETHOXY-6-METHYL-3,4-DIHYDRO-1H-ISOQUINOLIN E-2-CARBALDEHYDE
| Molecular Formula | C15H21NO5 |
| Molecular Weight | 295.14197 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 68.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.14197 Da |
| Heavy Atoms | 21 |
| Complexity | 353.0 |
| SMILES | CC1=C(C2=C(C(N(CC2)C=O)CO)C(=C1OC)OC)OC |
| InChIKey | SHGQFUADXRFCRN-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde. Following Lipinski's Rule of Five, 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde is 124867-50-1.
The molecular formula of 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde is C15H21NO5.
The molecular weight of 1-(hydroxymethyl)-5,7,8-trimethoxy-6-methyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde is 295.14197 g/mol.
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