TL;DR: F1600-0018 (CAS 1052543-76-6) is a chemical compound with molecular formula C21H32ClN3O4 and molecular weight 425.20813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-1,2-dimethylindole-3-carboxylate;hydrochloride
Also Known As: F1600-0018, ethyl 5-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-1,2-dimethyl-1H-indole-3-carboxylate hydrochloride, ethyl 5-(2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy)-1,2-dimethyl-1H-indole-3-carboxylate hydrochloride, 5-[2-Hydroxy-3-(4-methyl-piperazin-1-yl)-propoxy]-1,2-dimethyl-1H-indole-3-carbo, ethyl 5-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-1,2-dimethylindole-3-carboxylate hydrochloride
| Molecular Formula | C21H32ClN3O4 |
| Molecular Weight | 425.20813 g/mol |
| XLogP | 2.07232 |
| Topological Polar Surface Area (TPSA) | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 425.20813 Da |
| Heavy Atoms | 29 |
| Complexity | 512.0 |
| SMILES | CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)C)O)C)C.Cl |
| InChIKey | SERXBBLQQLJMNW-UHFFFAOYSA-N |
The XLogP value of 2.07232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1600-0018. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F1600-0018. Following Lipinski's Rule of Five, F1600-0018 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of F1600-0018 is 1052543-76-6.
The molecular formula of F1600-0018 is C21H32ClN3O4.
The molecular weight of F1600-0018 is 425.20813 g/mol.
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