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

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

CAS No.:
1375183-55-3
Catalog Number:
AG01AHIL
Molecular Formula:
C14H21Cl2N3
Molecular Weight:
302.2426
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Product Description
Catalog Number:
AG01AHIL
Chemical Name:
1-(propan-2-yl)-2-(pyrrolidin-2-yl)-1H-1,3-benzodiazole dihydrochloride
CAS Number:
1375183-55-3
Molecular Formula:
C14H21Cl2N3
Molecular Weight:
302.2426
MDL Number:
MFCD21602410
IUPAC Name:
1-propan-2-yl-2-pyrrolidin-2-ylbenzimidazole;dihydrochloride
InChI:
InChI=1S/C14H19N3.2ClH/c1-10(2)17-13-8-4-3-6-11(13)16-14(17)12-7-5-9-15-12;;/h3-4,6,8,10,12,15H,5,7,9H2,1-2H3;2*1H
InChI Key:
QXNFTZZVUFEWLC-UHFFFAOYSA-N
SMILES:
CC(n1c(nc2c1cccc2)C1CCCN1)C.Cl.Cl
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.111g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
302.243g/mol
Monoisotopic Mass:
301.111g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties