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852027-47-5,MFCD07296271
Catalog No.:AA019WT2

852027-47-5 | 1-(4-Methylphenyl)-3-prop-2-yn-1-ylurea

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$178.00   $125.00
- +
1g
95%
in stock  
$427.00   $299.00
- +
5g
95%
in stock  
$1,258.00   $881.00
- +
10g
95%
in stock  
$2,007.00   $1,405.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA019WT2
Chemical Name:
1-(4-Methylphenyl)-3-prop-2-yn-1-ylurea
CAS Number:
852027-47-5
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD07296271
SMILES:
C#CCNC(=O)Nc1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
233  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
1.4  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:852027-47-5 Molecular Formula|852027-47-5 MDL|852027-47-5 SMILES|852027-47-5 1-(4-Methylphenyl)-3-prop-2-yn-1-ylurea