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1048915-54-3,MFCD00955183
Catalog No.:AA00ITDW

1048915-54-3 | 6-imino-2-oxo-5-[(E)-[(thiophen-3-yl)methylidene]amino]-1-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyrimidine-4-carbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$281.00   $197.00
- +
5mg
>90%
1 week  
$297.00   $208.00
- +
10mg
>90%
1 week  
$327.00   $229.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00ITDW
Chemical Name:
6-imino-2-oxo-5-[(E)-[(thiophen-3-yl)methylidene]amino]-1-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyrimidine-4-carbonitrile
CAS Number:
1048915-54-3
Molecular Formula:
C17H10F3N5OS
Molecular Weight:
389.3544
MDL Number:
MFCD00955183
SMILES:
N#Cc1[nH]c(=O)n(c(=N)c1/N=C/c1cscc1)c1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
751  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.8  

Literature
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SDS
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Tags:1048915-54-3 Molecular Formula|1048915-54-3 MDL|1048915-54-3 SMILES|1048915-54-3 6-imino-2-oxo-5-[(E)-[(thiophen-3-yl)methylidene]amino]-1-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyrimidine-4-carbonitrile
Catalog No.: AA00ITDW
1048915-54-3,MFCD00955183
1048915-54-3 | 6-imino-2-oxo-5-[(E)-[(thiophen-3-yl)methylidene]amino]-1-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyrimidine-4-carbonitrile
Pack Size： 1mg
Purity： >90%
1 week
$281.00 $197.00
Pack Size： 5mg
Purity： >90%
1 week
$297.00 $208.00
Pack Size： 10mg
Purity： >90%
1 week
$327.00 $229.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00ITDW
Chemical Name: 6-imino-2-oxo-5-[(E)-[(thiophen-3-yl)methylidene]amino]-1-[3-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyrimidine-4-carbonitrile
CAS Number: 1048915-54-3
Molecular Formula: C17H10F3N5OS
Molecular Weight: 389.3544
MDL Number: MFCD00955183
SMILES: N#Cc1[nH]c(=O)n(c(=N)c1/N=C/c1cscc1)c1cccc(c1)C(F)(F)F
Properties
Complexity: 751  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 27  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.8  
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