TL;DR: F6548-4006 (CAS 1023456-32-7) is a chemical compound with molecular formula C29H27N5O5S and molecular weight 557.1733 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[5-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-[(4-methoxyphenyl)methyl]acetamide
Also Known As: F6548-4006, N-(3-methoxyphenyl)-2-{[2-({[(4-methoxyphenyl)methyl]carbamoyl}methyl)-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl}acetamide, 2-[5-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-[(4-methoxyphenyl)methyl]acetamide, 2-[(2-{2-[(4-methoxybenzyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)thio]-N-(3-methoxyphenyl)acetamide, N-(4-methoxybenzyl)-2-(5-((2-((3-methoxyphenyl)amino)-2-oxoethyl)thio)-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-2-yl)acetamide
| Molecular Formula | C29H27N5O5S |
| Molecular Weight | 557.1733 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 557.1733 Da |
| Heavy Atoms | 40 |
| Complexity | 997.0 |
| SMILES | COC1=CC=C(C=C1)CNC(=O)CC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC(=O)NC5=CC(=CC=C5)OC |
| InChIKey | OEFQNGTYGKVVIP-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that F6548-4006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting F6548-4006 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F6548-4006 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of F6548-4006 is 1023456-32-7.
The molecular formula of F6548-4006 is C29H27N5O5S.
The molecular weight of F6548-4006 is 557.1733 g/mol.
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