Home Other Building Blocks 5-[hydroxy(piperidin-4-yl)methyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

5-[hydroxy(piperidin-4-yl)methyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS No.:
1094442-06-4
Catalog Number:
AG01A2H0
Molecular Formula:
C12H19N3O3
Molecular Weight:
253.2976
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Product Description
Catalog Number:
AG01A2H0
Chemical Name:
5-[hydroxy(piperidin-4-yl)methyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CAS Number:
1094442-06-4
Molecular Formula:
C12H19N3O3
Molecular Weight:
253.2976
MDL Number:
MFCD11186080
IUPAC Name:
5-[hydroxy(piperidin-4-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione
InChI:
InChI=1S/C12H19N3O3/c1-14-7-9(11(17)15(2)12(14)18)10(16)8-3-5-13-6-4-8/h7-8,10,13,16H,3-6H2,1-2H3
InChI Key:
ZTPNRIUTAPHDET-UHFFFAOYSA-N
SMILES:
OC(c1cn(C)c(=O)n(c1=O)C)C1CCNCC1
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.143g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.302g/mol
Monoisotopic Mass:
253.143g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties