AC1LWTK1
propan-2-yl 5-methyl-2-[(2-oxochromene-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Also Known As: AK-968/40725738|isopropyl 5-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-4-phenyl-3-thiophenecarboxylate|propan-2-yl 5-methyl-2-[(2-oxochromene-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate|methylethyl 5-methyl-2-[(2-oxochromen-3-yl)carbonylamino]-4-phenylthiophene-3- carboxylate|PROPAN-2-YL 5-METHYL-2-(2-OXO-2H-CHROMENE-3-AMIDO)-4-PHENYLTHIOPHENE-3-CARBOXYLATE|propan-2-yl 5-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-4-phenylthiophene-3-carboxylate
| Molecular Formula | C25H21NO5S |
|---|---|
| Molecular Weight | 447.11404 g/mol |
| LogP | 5.64742 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.11404 |
| Monoisotopic Mass | 447.11404 |
| Heavy Atoms | 32 |
| Complexity | 1368.3638 |
Chemical Identifiers
| CAS Number | 445014-84-6 |
|---|---|
| SMILES | CC1=C(C(=C(S1)NC(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)OC(C)C)C4=CC=CC=C4 |
Product Overview
AC1LWTK1 (CAS 445014-84-6), with molecular formula C25H21NO5S and molecular weight 447.11404 g/mol. IUPAC: propan-2-yl 5-methyl-2-[(2-oxochromene-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate.
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