TL;DR: 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide (CAS 155860-20-1) is a chemical compound with molecular formula C14H11N3O3S and molecular weight 301.05212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxochromene-2-carboxamide
Also Known As: 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide, AB01283196-01, 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxochromene-2-carboxamide, N-(5-methyl(1,3,4-thiadiazol-2-yl))(6-methyl-4-oxochromen-2-yl)carboxamide, 6-methyl-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
| Molecular Formula | C14H11N3O3S |
| Molecular Weight | 301.05212 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.05212 Da |
| Heavy Atoms | 21 |
| Complexity | 482.0 |
| SMILES | CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)NC3=NN=C(S3)C |
| InChIKey | QJSXTFPFVVZAFP-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide. Following Lipinski's Rule of Five, 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-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 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide is 155860-20-1.
The molecular formula of 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide is C14H11N3O3S.
The molecular weight of 6-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide is 301.05212 g/mol.
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