373368-99-1,MFCD01457673
Catalog No.:AA01F2IV

373368-99-1 | Ethyl 2-[[1-[(2-furanylcarbonyl)amino]-2-(4-methylphenyl)-2-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylate

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Purity
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25mg
95%
in stock  
$279.00   $195.00
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  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA01F2IV
Chemical Name:
Ethyl 2-[[1-[(2-furanylcarbonyl)amino]-2-(4-methylphenyl)-2-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylate
CAS Number:
373368-99-1
Molecular Formula:
C27H24N2O5S
Molecular Weight:
488.5549
MDL Number:
MFCD01457673
SMILES:
CCOC(=O)c1c(scc1c1ccccc1)NC(C(=O)c1ccc(cc1)C)NC(=O)c1ccco1
Properties
Computed Properties
 
Complexity:
735  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
10  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
6.6  

Literature

Title: Diketo acid pharmacophore. 2. Discovery of structurally diverse inhibitors of HIV-1 integrase.

Journal: Journal of medicinal chemistry 20051215

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Tags:373368-99-1 Molecular Formula|373368-99-1 MDL|373368-99-1 SMILES|373368-99-1 Ethyl 2-[[1-[(2-furanylcarbonyl)amino]-2-(4-methylphenyl)-2-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylate
Catalog No.: AA01F2IV
373368-99-1,MFCD01457673
373368-99-1 | Ethyl 2-[[1-[(2-furanylcarbonyl)amino]-2-(4-methylphenyl)-2-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylate
Pack Size: 25mg
Purity: 95%
in stock
$279.00 $195.00
Quantity
- +
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Technical Information
Catalog Number: AA01F2IV
Chemical Name: Ethyl 2-[[1-[(2-furanylcarbonyl)amino]-2-(4-methylphenyl)-2-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylate
CAS Number: 373368-99-1
Molecular Formula: C27H24N2O5S
Molecular Weight: 488.5549
MDL Number: MFCD01457673
SMILES: CCOC(=O)c1c(scc1c1ccccc1)NC(C(=O)c1ccc(cc1)C)NC(=O)c1ccco1
Properties
Complexity: 735  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 35  
Hydrogen Bond Acceptor Count: 7  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 10  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 6.6  
Literature fold

Title: Diketo acid pharmacophore. 2. Discovery of structurally diverse inhibitors of HIV-1 integrase.

Journal: Journal of medicinal chemistry20051215

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