TL;DR: 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline (CAS 111066-23-0) is a chemical compound with molecular formula C19H19N and molecular weight 261.15176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dimethyl-3-phenyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraene
Also Known As: BAS 00547419, IDI1_022393, 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline, BRD-K59998001-001-01-7, BRD-K59998001-001-02-5
| Molecular Formula | C19H19N |
| Molecular Weight | 261.15176 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 4.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.15176 Da |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
| SMILES | CC1=CC2=C3C(=C1)C(=C(N3CCC2)C)C4=CC=CC=C4 |
| InChIKey | PIJUYPHMPVRHIJ-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.9 Ų, 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline is 111066-23-0.
The molecular formula of 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline is C19H19N.
The molecular weight of 2,8-Dimethyl-1-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline is 261.15176 g/mol.
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