TL;DR: Bionet1_003224 (CAS 478246-81-0) is a chemical compound with molecular formula C20H18N2OS2 and molecular weight 366.08606 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-methoxyphenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine
Also Known As: Bionet1_003224, 9N-316S, methyl 4-{[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)sulfanyl]methyl}phenyl ether, 2-[(4-methoxyphenyl)methylsulfanyl]-9-methyl-5H-thiochromeno[4,3-d]pyrimidine, 2-{[(4-methoxyphenyl)methyl]sulfanyl}-9-methyl-5H-thiochromeno[4,3-d]pyrimidine
| Molecular Formula | C20H18N2OS2 |
| Molecular Weight | 366.08606 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 85.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.08606 Da |
| Heavy Atoms | 25 |
| Complexity | 430.0 |
| SMILES | CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC4=CC=C(C=C4)OC |
| InChIKey | JQGVIYOGFLSERJ-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that Bionet1_003224 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_003224. Following Lipinski's Rule of Five, Bionet1_003224 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bionet1_003224 is 478246-81-0.
The molecular formula of Bionet1_003224 is C20H18N2OS2.
The molecular weight of Bionet1_003224 is 366.08606 g/mol.
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