Home Other Building Blocks 2-(piperidin-3-yl)-1-(propan-2-yl)-1H-1,3-benzodiazole dihydrochloride

2-(piperidin-3-yl)-1-(propan-2-yl)-1H-1,3-benzodiazole dihydrochloride

CAS No.:
1185300-76-8
Catalog Number:
AG01AHNH
Molecular Formula:
C15H23Cl2N3
Molecular Weight:
316.2692
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Product Description
Catalog Number:
AG01AHNH
Chemical Name:
2-(piperidin-3-yl)-1-(propan-2-yl)-1H-1,3-benzodiazole dihydrochloride
CAS Number:
1185300-76-8
Molecular Formula:
C15H23Cl2N3
Molecular Weight:
316.2692
MDL Number:
MFCD11506440
IUPAC Name:
2-piperidin-3-yl-1-propan-2-ylbenzimidazole;dihydrochloride
InChI:
InChI=1S/C15H21N3.2ClH/c1-11(2)18-14-8-4-3-7-13(14)17-15(18)12-6-5-9-16-10-12;;/h3-4,7-8,11-12,16H,5-6,9-10H2,1-2H3;2*1H
InChI Key:
LLHHNYBJECNRQM-UHFFFAOYSA-N
SMILES:
CC(n1c(nc2c1cccc2)C1CCCNC1)C.Cl.Cl
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.127g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
316.27g/mol
Monoisotopic Mass:
315.127g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties