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Home Amines 100987-04-0
100987-04-0,MFCD00980739
Catalog No.:AA0003AV
100987-04-0 | 2-Amino-5-(4-tert-butylphenyl)-1,3,4-thiadiazole
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95+%
2 weeks  
$65.00   $46.00
- +
1g
95+%
2 weeks  
$76.00   $53.00
- +
5g
95+%
2 weeks  
$114.00   $80.00
- +
10g
95+%
2 weeks  
$148.00   $104.00
- +
25g
95+%
2 weeks  
$229.00   $160.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0003AV
Chemical Name:
2-Amino-5-(4-tert-butylphenyl)-1,3,4-thiadiazole
CAS Number:
100987-04-0
Molecular Formula:
C12H15N3S
Molecular Weight:
233.3326
MDL Number:
MFCD00980739
IUPAC Name:
5-(4-tert-butylphenyl)-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C12H15N3S/c1-12(2,3)9-6-4-8(5-7-9)10-14-15-11(13)16-10/h4-7H,1-3H3,(H2,13,15)
InChI Key:
WEVOCASZWAUYHD-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)c1nnc(s1)N)(C)C
Properties
Computed Properties
 
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.099g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.333g/mol
Monoisotopic Mass:
233.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Synonyms
 
100987-04-0 
5-(4-tert-Butylphenyl)-1,3,4-thiadiazol-2-amine 
Oprea1_565061 
MLS000856186 
CHEMBL1559820 
REGID_for_CID_811160 
SCHEMBL10372142 
CTK6A4979 
KS-00000IWS 
WEVOCASZWAUYHD-UHFFFAOYSA-N 
5-[4-(1,1-dimethylethyl)phenyl]-1,3,4-Thiadiazol-2-amine 
HMS2694G10 
2-AMINO-5-(4-TERT-BUTYLPHENYL)-1,3,4-THIADIAZOLE 
ZINC322751 
ALBB-012594 
ATD-0031 
CCG-9578 
ZX-AN011391 
ZX-BK000458 
7304AC 
BBL002952 
MFCD00980739 
SBB004451 
5-(4-(tert-Butyl)phenyl)-1,3,4-thiadiazol-2-amine 
STK038723 
AKOS000225417 
MCULE-8121240601 
RTR-041967 
AJ-19243 
BAS 00599052 
DS-17216 
SMR000286631 
SY014218 
BIM-0022648.P001 
AK-83437 
AB0216967 
AX8185317 
BC4161903 
DB-058547 
TR-041967 
EU-0001526 
FT-0705473 
ST50003623 
MFCD00980739 (95%) 
K-0205 
1,3,4-Thiadiazol-2-amine, 5-[4-(1,1-dimethylethyl)phenyl]- 
SR-01000400617 
SR-01000400617-1 
5-(4-tert-Butyl-phenyl)-[1,3,4]thiadiazol-2-ylamine 
C12H15N3S 
CID811160 
ZINC00322751 
916317-00-5 
5-[4-(tert-butyl)phenyl]-1,3,4-thiadiazole-2-ylamine 
AC1LFYO3 
CBMicro_022474 
Oprea1_284217 
Literature

Title: Small molecules enhance autophagy and reduce toxicity in Huntington's disease models.

Journal: Nature chemical biology 20070601

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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