TL;DR: Bionet1_004591 (CAS 1008866-58-7) is a chemical compound with molecular formula C19H23N3O3S and molecular weight 373.14603 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(cyclohexylmethyl)-8,9-dimethoxy-5-sulfanylidene-1,3-dihydroimidazo[1,2-c]quinazolin-2-one
Also Known As: Bionet1_004591, 3-(cyclohexylmethyl)-8,9-dimethoxy-5-thioxo-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one, 6R-0236, 3-(cyclohexylmethyl)-8,9-dimethoxy-5-sulfanylidene-1,3-dihydroimidazo[1,2-c]quinazolin-2-one, 3-(cyclohexylmethyl)-8,9-dimethoxy-5-sulfanylidene-2H,3H,5H,6H-imidazo[1,2-c]quinazolin-2-one
| Molecular Formula | C19H23N3O3S |
| Molecular Weight | 373.14603 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 95.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.14603 Da |
| Heavy Atoms | 26 |
| Complexity | 775.0 |
| SMILES | COC1=CC2=C3NC(=O)C(N3C(=S)N=C2C=C1OC)CC4CCCCC4 |
| InChIKey | XZWCQBSTNFQXQX-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that Bionet1_004591 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004591. Following Lipinski's Rule of Five, Bionet1_004591 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bionet1_004591 is 1008866-58-7.
The molecular formula of Bionet1_004591 is C19H23N3O3S.
The molecular weight of Bionet1_004591 is 373.14603 g/mol.
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