TL;DR: SK&F 105809 (CAS 122454-69-7) is a chemical compound with molecular formula C18H17N3OS and molecular weight 323.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylsulfinylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
Also Known As: SK&F 105809, 5H-Pyrrolo(1,2-a)imidazole, 6,7-dihydro-2-(4-(methylsulfinyl)phenyl)-3-(4-pyridinyl)-, 2-(4-methylsulfinylphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole, 6,7-Dihydro-2-(4-(methylsulfinyl)phenyl)-3-(4-pyridyl)-5(1H)-pyrrolo(1,2-a)imidazole, (4-Methylsulfinylphenyl)-3-(4-pyridyl)-6,7-dihydro-[5H]pyrrolo[1,2 a]imidazole
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H17N3OS |
| Molecular Weight | 323.10922 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 67.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.10922 Da |
| Heavy Atoms | 23 |
| Complexity | 432.0 |
| SMILES | CS(=O)C1=CC=C(C=C1)C2=C(N3CCCC3=N2)C4=CC=NC=C4 |
| InChIKey | KSEJZTWORQXILM-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SK&F 105809. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SK&F 105809. Following Lipinski's Rule of Five, SK&F 105809 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of SK&F 105809 is 122454-69-7.
The molecular formula of SK&F 105809 is C18H17N3OS.
The molecular weight of SK&F 105809 is 323.10922 g/mol.
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