TL;DR: Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]- (CAS 112833-17-7) is a chemical compound with molecular formula C13H14N2O2S and molecular weight 262.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(4-methoxyanilino)-4-methyl-1,3-thiazol-5-yl]ethanone
Also Known As: BAS 00393395, Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]-, 1-[2-(4-methoxyanilino)-4-methyl-1,3-thiazol-5-yl]ethanone, T0518-8256, 1-[2-(4-Methoxy-phenylamino)-4-methyl-thiazol-5-yl]-ethanone
| Molecular Formula | C13H14N2O2S |
| Molecular Weight | 262.0776 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 79.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.0776 Da |
| Heavy Atoms | 18 |
| Complexity | 293.0 |
| SMILES | CC1=C(SC(=N1)NC2=CC=C(C=C2)OC)C(=O)C |
| InChIKey | GGVWMEYEQPOQJU-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]-. Following Lipinski's Rule of Five, Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]- has 1 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 Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]- is 112833-17-7.
The molecular formula of Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]- is C13H14N2O2S.
The molecular weight of Ethanone, 1-[2-[(4-methoxyphenyl)amino]-4-methyl-5-thiazolyl]- is 262.0776 g/mol.
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