TL;DR: 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline (CAS 163557-60-6) is a chemical compound with molecular formula C11H15N3 and molecular weight 189.1266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,3-dimethyl-4H-isoquinolin-1-yl)hydrazine
Also Known As: (3,3-dimethyl-4H-isoquinolin-1-yl)hydrazine, 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline, J1.130.736A, 1-hydrazino-3,3-dimethyl-3,4-dihydroisoquinoline, 1-hydrazinyl-3,3-dimethyl-3,4-dihydroisoquinoline
| Molecular Formula | C11H15N3 |
| Molecular Weight | 189.1266 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.1266 Da |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
| SMILES | CC1(CC2=CC=CC=C2C(=N1)NN)C |
| InChIKey | RDJXEXRWYBHWRE-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline. With a topological polar surface area (TPSA) of 50.4 Ų, 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline is 163557-60-6.
The molecular formula of 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline is C11H15N3.
The molecular weight of 1-Hydrazono-3,3-dimethyl-1,2,3,4-tetrahydroisoquinoline is 189.1266 g/mol.
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