Home Amines 1426290-49-4
1426290-49-4,MFCD16653293
Catalog No.:AA01AQIW
1426290-49-4 | 1-[(2-Amino-1,3-thiazol-4-yl)methyl]piperidin-4-ol dihydrochloride
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Technical Information
Catalog Number:
AA01AQIW
Chemical Name:
1-[(2-Amino-1,3-thiazol-4-yl)methyl]piperidin-4-ol dihydrochloride
CAS Number:
1426290-49-4
Molecular Formula:
C9H17Cl2N3OS
Molecular Weight:
286.2218
MDL Number:
MFCD16653293
IUPAC Name:
1-[(2-amino-1,3-thiazol-4-yl)methyl]piperidin-4-ol;dihydrochloride
InChI:
InChI=1S/C9H15N3OS.2ClH/c10-9-11-7(6-14-9)5-12-3-1-8(13)2-4-12;;/h6,8,13H,1-5H2,(H2,10,11);2*1H
InChI Key:
UOBLBOWRWPGODP-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)Cc1csc(n1)N.Cl.Cl
Properties
Computed Properties
 
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.047g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
286.215g/mol
Monoisotopic Mass:
285.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
1-[(2-amino-1,3-thiazol-4-yl)methyl]piperidin-4-ol dihydrochloride 
1426290-49-4 
AKOS023092982 
MCULE-9554750455 
L-3910 
F2158-1255 
Literature
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