CBMicro_006013
[2-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate
Also Known As: CBMicro_006013|BIM-0005838.P001|SR-01000457199-1|2-methoxy-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 2-thiophenecarboxylate|2-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl thiophene-2-carboxylate|[2-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate|2-METHOXY-4-{[(4E)-3-METHYL-5-OXO-1-PHENYL-4,5-DIHYDRO-1H-PYRAZOL-4-YLIDENE]METHYL}PHENYL THIOPHENE-2-CARBOXYLATE
| Molecular Formula | C23H18N2O4S |
|---|---|
| Molecular Weight | 418.09872 g/mol |
| LogP | 4.782 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.09872 |
| Monoisotopic Mass | 418.09872 |
| Heavy Atoms | 30 |
| Complexity | 1151.2109 |
Chemical Identifiers
| CAS Number | 6191-79-3 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OC(=O)C3=CC=CS3)OC)C4=CC=CC=C4 |
Product Overview
CBMicro_006013 (CAS 6191-79-3), with molecular formula C23H18N2O4S and molecular weight 418.09872 g/mol. IUPAC: [2-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate.
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