Home Other Building Blocks 1011301-27-1
1011301-27-1,MFCD25976437
Catalog No.:AA0003QL
1011301-27-1 | Tenovin-3
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
99%
1 week  
$184.00   $129.00
- +
5mg
99%
1 week  
$336.00   $235.00
- +
10mg
99%
1 week  
$546.00   $382.00
- +
25mg
99%
1 week  
$1,098.00   $769.00
- +
50mg
99%
1 week  
$1,841.00   $1,289.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0003QL
Chemical Name:
Tenovin-3
CAS Number:
1011301-27-1
Molecular Formula:
C18H21N3OS
Molecular Weight:
327.4438
MDL Number:
MFCD25976437
IUPAC Name:
N-[(4-aminophenyl)carbamothioyl]-4-tert-butylbenzamide
InChI:
InChI=1S/C18H21N3OS/c1-18(2,3)13-6-4-12(5-7-13)16(22)21-17(23)20-15-10-8-14(19)9-11-15/h4-11H,19H2,1-3H3,(H2,20,21,22,23)
InChI Key:
NLAXTZPUTNGRDU-UHFFFAOYSA-N
SMILES:
S=C(NC(=O)c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)N
Properties
Computed Properties
 
Complexity:
417  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.141g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
327.446g/mol
Monoisotopic Mass:
327.141g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
99.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

Synonyms
 
Tenovin-3 
1011301-27-1 
EX-A264 
NLAXTZPUTNGRDU-UHFFFAOYSA-N 
BCP08754 
KS-00000LF2 
MFCD25976437 
ZINC84704236 
AKOS025122815 
Benzamide, N-[[(4-aminophenyl)amino]thioxomethyl]-4-(1,1-dimethylethyl)- 
CS-5581 
AS-16829 
1-(4-Amino-phenyl)-3-(4-tert-butyl-benzoyl)-thiourea 
DA-48392 
HY-19339 
AB0095643 
FT-0723797 
A13727 
J-690007 
N-(4-aminophenylcarbamothioyl)-4-tert-butylbenzamide 
N-((4-aminophenyl)carbamothioyl)-4-(tert-butyl)benzamide 
N-{[(4-aminophenyl)amino]carbonothioyl}-4-tert-butylbenzamide 
Niraparib hydrochloride 
QC-514 
ACN-029554 
A8567 
AK340961 
N-[(4-aminophenyl)carbamothioyl]-4-tert-butylbenzamide 
SCHEMBL907336 
CHEMBL2041442 
AOB5040 
DTXSID10647243 
Literature

Title: SAR analysis of a series of acylthiourea derivatives possessing broad-spectrum antiviral activity.

Journal: Bioorganic & medicinal chemistry letters 20120701

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