TL;DR: F6548-3704 (CAS 1044590-15-9) is a chemical compound with molecular formula C27H24FN5O4S and molecular weight 533.1533 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-fluorophenyl)methyl]-3-[5-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide
Also Known As: F6548-3704, N-[(4-fluorophenyl)methyl]-3-[5-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]propanamide, N-[(4-fluorophenyl)methyl]-3-{5-[({[(furan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-2-yl}propanamide
| Molecular Formula | C27H24FN5O4S |
| Molecular Weight | 533.1533 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 533.1533 Da |
| Heavy Atoms | 38 |
| Complexity | 954.0 |
| SMILES | C1=CC=C2C(=C1)C3=NC(C(=O)N3C(=N2)SCC(=O)NCC4=CC=CO4)CCC(=O)NCC5=CC=C(C=C5)F |
| InChIKey | ZDPQWJNQWCOIAA-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F6548-3704. The TPSA of 142.0 Ų indicates high polarity, suggesting F6548-3704 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F6548-3704 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of F6548-3704 is 1044590-15-9.
The molecular formula of F6548-3704 is C27H24FN5O4S.
The molecular weight of F6548-3704 is 533.1533 g/mol.
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