TL;DR: Som 1122 (CAS 73865-18-6) is a chemical compound with molecular formula C20H24FN3O2 and molecular weight 357.18524 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-[[4-(benzimidazol-1-yl)-2-methylbutan-2-yl]amino]-1-hydroxyethyl]-3-fluorophenol
Also Known As: Nardeterol, Nardeterolum, Nardeterol [INN], Som 1122, Nardeterolum [INN-Latin]
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H24FN3O2 |
| Molecular Weight | 357.18524 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 70.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.18524 Da |
| Heavy Atoms | 26 |
| Complexity | 451.0 |
| SMILES | CC(C)(CCN1C=NC2=CC=CC=C21)NCC(C3=C(C=C(C=C3)O)F)O |
| InChIKey | KOTMQCNDGLTIHR-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Som 1122. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Som 1122. Following Lipinski's Rule of Five, Som 1122 has 3 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 Som 1122 is 73865-18-6.
The molecular formula of Som 1122 is C20H24FN3O2.
The molecular weight of Som 1122 is 357.18524 g/mol.
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