Home Other Building Blocks 4-(4-methoxyphenyl)-2-(piperidin-4-yl)pyrimidine dihydrochloride

4-(4-methoxyphenyl)-2-(piperidin-4-yl)pyrimidine dihydrochloride

CAS No.:
2044902-84-1
Catalog Number:
AG01BXX0
Molecular Formula:
C16H21Cl2N3O
Molecular Weight:
342.2634
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Product Description
Catalog Number:
AG01BXX0
Chemical Name:
4-(4-methoxyphenyl)-2-(piperidin-4-yl)pyrimidine dihydrochloride
CAS Number:
2044902-84-1
Molecular Formula:
C16H21Cl2N3O
Molecular Weight:
342.2634
MDL Number:
MFCD30488064
IUPAC Name:
4-(4-methoxyphenyl)-2-piperidin-4-ylpyrimidine;dihydrochloride
InChI:
InChI=1S/C16H19N3O.2ClH/c1-20-14-4-2-12(3-5-14)15-8-11-18-16(19-15)13-6-9-17-10-7-13;;/h2-5,8,11,13,17H,6-7,9-10H2,1H3;2*1H
InChI Key:
ZQLQSUSFTFYFKS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1ccnc(n1)C1CCNCC1.Cl.Cl
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.106g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
342.264g/mol
Monoisotopic Mass:
341.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties