Home Aminos 3-amino-1-(2-methylcyclohexyl)thiourea

3-amino-1-(2-methylcyclohexyl)thiourea

CAS No.:
748776-62-7
Catalog Number:
AG019HKU
Molecular Formula:
C8H17N3S
Molecular Weight:
187.3057
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Product Description
Catalog Number:
AG019HKU
Chemical Name:
3-amino-1-(2-methylcyclohexyl)thiourea
CAS Number:
748776-62-7
Molecular Formula:
C8H17N3S
Molecular Weight:
187.3057
MDL Number:
MFCD03653073
IUPAC Name:
1-amino-3-(2-methylcyclohexyl)thiourea
InChI:
InChI=1S/C8H17N3S/c1-6-4-2-3-5-7(6)10-8(12)11-9/h6-7H,2-5,9H2,1H3,(H2,10,11,12)
InChI Key:
FOHGZWSUKUQQKG-UHFFFAOYSA-N
SMILES:
NNC(=S)NC1CCCCC1C
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.114g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
187.305g/mol
Monoisotopic Mass:
187.114g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties