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15679-13-7

15679-13-7 | Thiazole, 4-methyl-2-(1-methylethyl)-

CAS No: 15679-13-7 Catalog No: AG001P00 MDL No:MFCD00036561

Product Description

Catalog Number:
AG001P00
Chemical Name:
Thiazole, 4-methyl-2-(1-methylethyl)-
CAS Number:
15679-13-7
Molecular Formula:
C7H11NS
Molecular Weight:
141.2339
MDL Number:
MFCD00036561
IUPAC Name:
4-methyl-2-propan-2-yl-1,3-thiazole
InChI:
InChI=1S/C7H11NS/c1-5(2)7-8-6(3)4-9-7/h4-5H,1-3H3
InChI Key:
OFLXNHNYPQPQKW-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)C(C)C
EC Number:
239-758-4
UNII:
NQF7JO3MUP
FEMA Number:
3555

Properties

Complexity:
92.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.061g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.232g/mol
Monoisotopic Mass:
141.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Literature

Title Journal
Molecular Basis for Drug Resistance in HIV-1 Protease. Viruses 20101101

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