TL;DR: 3M-003 (CAS 162397-26-4) is a chemical compound with molecular formula C17H26N4O2 and molecular weight 318.20557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-amino-2-(ethoxymethyl)-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol
Also Known As: 3M-003, 1-(4-Amino-2-(ethoxymethyl)-6,7,8,9-tetrahydro-1H-imidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol, 1-[4-amino-2-(ethoxymethyl)-6,7,8,9-tetrahydroimidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol, T29413
| Molecular Formula | C17H26N4O2 |
| Molecular Weight | 318.20557 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 86.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.20557 Da |
| Heavy Atoms | 23 |
| Complexity | 406.0 |
| SMILES | CCOCC1=NC2=C(N1CC(C)(C)O)C3=C(CCCC3)N=C2N |
| InChIKey | JGPXFNFCEPOWRD-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3M-003. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3M-003. Following Lipinski's Rule of Five, 3M-003 has 2 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 3M-003 is 162397-26-4.
The molecular formula of 3M-003 is C17H26N4O2.
The molecular weight of 3M-003 is 318.20557 g/mol.
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