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Home > Imidazoles > 1955548-12-5
1955548-12-5 | 1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-c]pyridin-2-one dihydrochloride
CAS No: 1955548-12-5 Catalog No: AG01AUY5 MDL No:MFCD29041253
Product Description
Catalog Number:
AG01AUY5
Chemical Name:
1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-c]pyridin-2-one dihydrochloride
CAS Number:
1955548-12-5
Molecular Formula:
C11H16Cl2N4O
Molecular Weight:
291.1769
MDL Number:
MFCD29041253
IUPAC Name:
1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;dihydrochloride
InChI:
InChI=1S/C11H14N4O.2ClH/c16-11-14-9-7-13-6-3-10(9)15(11)8-1-4-12-5-2-8;;/h3,6-8,12H,1-2,4-5H2,(H,14,16);2*1H
InChI Key:
URHCVTHRMDCBMW-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c(n1C1CCNCC1)ccnc2.Cl.Cl
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.07g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
291.176g/mol
Monoisotopic Mass:
290.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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