Home Other Building Blocks 2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-6-amine

2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-6-amine

CAS No.:
1096321-61-7
Catalog Number:
AG019XL1
Molecular Formula:
C13H19N5
Molecular Weight:
245.3235
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Product Description
Catalog Number:
AG019XL1
Chemical Name:
2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-6-amine
CAS Number:
1096321-61-7
Molecular Formula:
C13H19N5
Molecular Weight:
245.3235
MDL Number:
MFCD11978899
IUPAC Name:
2-[(4-methylpiperazin-1-yl)methyl]-3H-benzimidazol-5-amine
InChI:
InChI=1S/C13H19N5/c1-17-4-6-18(7-5-17)9-13-15-11-3-2-10(14)8-12(11)16-13/h2-3,8H,4-7,9,14H2,1H3,(H,15,16)
InChI Key:
WNICNJQDIDVMMB-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)Cc1nc2c([nH]1)cc(cc2)N
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.164g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.33g/mol
Monoisotopic Mass:
245.164g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties