TL;DR: 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide (CAS 351001-09-7) is a chemical compound with molecular formula C21H18N4O2S and molecular weight 390.11505 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide
Also Known As: BIM-0046746.P001, 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide, [2-(3-ethoxyphenyl)(4-quinolyl)]-N-(5-methyl(1,3,4-thiadiazol-2-yl))carboxamid e, 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-quinolinecarboxamide
| Molecular Formula | C21H18N4O2S |
| Molecular Weight | 390.11505 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.11505 Da |
| Heavy Atoms | 28 |
| Complexity | 537.0 |
| SMILES | CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NN=C(S4)C |
| InChIKey | OMXKCYFBTUHVOZ-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide. Following Lipinski's Rule of Five, 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide is 351001-09-7.
The molecular formula of 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide is C21H18N4O2S.
The molecular weight of 2-(3-ethoxyphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide is 390.11505 g/mol.
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