473798-59-3,MFCD23103560
Catalog No.:AA00DNCK

473798-59-3 | 5-Amino-2,3-dihydro-2-(1-methylethyl)-4-(2-methylphenyl)-3-oxo-1H-pyrazole-1-carbothioic acid S-2-propen-1-yl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
2 weeks  
$1,756.00   $1,229.00
- +
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  • Properties
  • Literature
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Technical Information
Catalog Number:
AA00DNCK
Chemical Name:
5-Amino-2,3-dihydro-2-(1-methylethyl)-4-(2-methylphenyl)-3-oxo-1H-pyrazole-1-carbothioic acid S-2-propen-1-yl ester
CAS Number:
473798-59-3
Molecular Formula:
C17H21N3O2S
Molecular Weight:
331.4325
MDL Number:
MFCD23103560
SMILES:
C=CCSC(=O)n1c(N)c(c(=O)n1C(C)C)c1ccccc1C
Properties
Computed Properties
 
Complexity:
530  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.8  

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SDS
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Tags:473798-59-3 Molecular Formula|473798-59-3 MDL|473798-59-3 SMILES|473798-59-3 5-Amino-2,3-dihydro-2-(1-methylethyl)-4-(2-methylphenyl)-3-oxo-1H-pyrazole-1-carbothioic acid S-2-propen-1-yl ester
Catalog No.: AA00DNCK
473798-59-3,MFCD23103560
473798-59-3 | 5-Amino-2,3-dihydro-2-(1-methylethyl)-4-(2-methylphenyl)-3-oxo-1H-pyrazole-1-carbothioic acid S-2-propen-1-yl ester
Pack Size: 100mg
Purity:
2 weeks
$1,756.00 $1,229.00
Quantity
- +
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Technical Information
Catalog Number: AA00DNCK
Chemical Name: 5-Amino-2,3-dihydro-2-(1-methylethyl)-4-(2-methylphenyl)-3-oxo-1H-pyrazole-1-carbothioic acid S-2-propen-1-yl ester
CAS Number: 473798-59-3
Molecular Formula: C17H21N3O2S
Molecular Weight: 331.4325
MDL Number: MFCD23103560
SMILES: C=CCSC(=O)n1c(N)c(c(=O)n1C(C)C)c1ccccc1C
Properties
Complexity: 530  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 23  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.8  
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