TL;DR: F0921-6716 (CAS 1022284-51-0) is a chemical compound with molecular formula C29H31N5O5S and molecular weight 561.2046 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,3-benzodioxol-5-yl)-2-[[2-[2-(cyclohexylamino)-2-oxoethyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]butanamide
Also Known As: F0921-6716, N-(1,3-benzodioxol-5-yl)-2-[[2-[2-(cyclohexylamino)-2-oxoethyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]butanamide, N-(2H-1,3-benzodioxol-5-yl)-2-({2-[(cyclohexylcarbamoyl)methyl]-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-5-yl}sulfanyl)butanamide, N-(benzo[d][1,3]dioxol-5-yl)-2-((2-(2-(cyclohexylamino)-2-oxoethyl)-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)thio)butanamide, N-1,3-benzodioxol-5-yl-2-({2-[2-(cyclohexylamino)-2-oxoethyl]-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}thio)butanamide
| Molecular Formula | C29H31N5O5S |
| Molecular Weight | 561.2046 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 561.2046 Da |
| Heavy Atoms | 40 |
| Complexity | 1050.0 |
| SMILES | CCC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC4=CC=CC=C4C5=NC(C(=O)N53)CC(=O)NC6CCCCC6 |
| InChIKey | HRYGOTVRBZXETD-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that F0921-6716 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting F0921-6716 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0921-6716 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of F0921-6716 is 1022284-51-0.
The molecular formula of F0921-6716 is C29H31N5O5S.
The molecular weight of F0921-6716 is 561.2046 g/mol.
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