TL;DR: (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione (CAS 151637-19-3) is a chemical compound with molecular formula C20H23NO2 and molecular weight 309.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione
Also Known As: (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione, (11bR)-3,3,11b-trimethyl-3,4,6,7,11b,12-hexahydro-1H-isoquino[2,1-a]quinoline-1,13(2H)-dione, (R)-3,3,11b-trimethyl-3,4,6,7,11b,12-hexahydro-1H-isoquinolino[2,1-a]quinoline-1,13(2H)-dione
| Molecular Formula | C20H23NO2 |
| Molecular Weight | 309.17288 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 309.17288 Da |
| Heavy Atoms | 23 |
| Complexity | 603.0 |
| SMILES | C[C@]12CC(=O)C3=C(N1CCC4=CC=CC=C24)CC(CC3=O)(C)C |
| InChIKey | KKOOAOKFFRJNEJ-HXUWFJFHSA-N |
The XLogP value of 3.0 indicates that (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione has 0 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 (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione is 151637-19-3.
The molecular formula of (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione is C20H23NO2.
The molecular weight of (11bR)-3,3,11b-trimethyl-4,6,7,12-tetrahydro-2H-isoquinolino[2,1-a]quinoline-1,13-dione is 309.17288 g/mol.
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