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Home Other Building Blocks 1-(1H-1,3-benzodiazol-2-ylmethyl)piperidin-4-amine trihydrochloride

1-(1H-1,3-benzodiazol-2-ylmethyl)piperidin-4-amine trihydrochloride

CAS No.:
1334149-66-4
Catalog Number:
AG01AJQJ
Molecular Formula:
C13H21Cl3N4
Molecular Weight:
339.6916
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Product Description
Catalog Number:
AG01AJQJ
Chemical Name:
1-(1H-1,3-benzodiazol-2-ylmethyl)piperidin-4-amine trihydrochloride
CAS Number:
1334149-66-4
Molecular Formula:
C13H21Cl3N4
Molecular Weight:
339.6916
MDL Number:
MFCD19686335
IUPAC Name:
1-(1H-benzimidazol-2-ylmethyl)piperidin-4-amine;trihydrochloride
InChI:
InChI=1S/C13H18N4.3ClH/c14-10-5-7-17(8-6-10)9-13-15-11-3-1-2-4-12(11)16-13;;;/h1-4,10H,5-9,14H2,(H,15,16);3*1H
InChI Key:
IXSXULAKKISMDE-UHFFFAOYSA-N
SMILES:
NC1CCN(CC1)Cc1nc2c([nH]1)cccc2.Cl.Cl.Cl
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.083g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
339.689g/mol
Monoisotopic Mass:
338.083g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties