Basic information
- CAS
315671-25-1- Standard SMILES
Cc1ccc(NC(=O)CCC(=O)NNC(=S)Nc2ccc(F)cc2)c(C)c1- InChIKey
GRIFESWTLSDEAU-UHFFFAOYSA-N- Molecular formula
- C19H21FN4O2S
- Average molar mass
- 388.5 g/mol
- Monoisotopic mass
- 388.13692526
Names & identifiers
- Preferred name
- N-(2,4-dimethylphenyl)-4-{2-[(4-fluoroanilino)carbothioyl]hydrazino}-4-oxobutanamide
- IUPAC
- N-(2,4-dimethylphenyl)-4-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-4-oxobutanamide
- English name
- N-(2,4-dimethylphenyl)-4-(2-{[(4-fluorophenyl)amino]carbonothioyl}hydrazino)-4-oxobutanamide
- Molecular formula
- C19H21FN4O2S
- Molecular weight
- 388.46
Names & synonyms
315671-25-1N-(2,4-dimethylphenyl)-4-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-4-oxobutanamideN-(2,4-dimethylphenyl)-4-{2-[(4-fluoroanilino)carbothioyl]hydrazino}-4-oxobutanamideN-(2,4-dimethylphenyl)-4-{2-[(4-fluorophenyl)carbamothioyl]hydrazinyl}-4-oxobutanamideMLS001215387CHEMBL1728948HMS2908K09STK022872AKOS000488262N-(2,4-dimethylphenyl)-N'-{[(4-fluorophenyl)carbamothioyl]amino}butanediamideSMR000611367ST040627
Show more names
N-(2,4-dimethylphenyl)-4-(2-{[(4-fluorophenyl)amino]carbonothioyl}hydrazino)-4-oxobutanamideButanoic acid, 4-[(2,4-dimethylphenyl)amino]-4-oxo-, 2-[[(4-fluorophenyl)amino]thioxomethyl]hydrazide
AN-329/40522119SR-01000311394SR-01000311394-1Z57201886N-(2,4-dimethylphenyl)-N'-({[(4-fluorophenyl)amino]thioxomethyl}amino)butane-1 ,4-diamide
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 526
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
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Compound notes
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