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1340269-19-3 | 5-AMINO-3-BENZYL-1-ETHYL-1,2,3,4-TETRAHYDROPYRIMIDINE-2,4-DIONE
CAS No: 1340269-19-3 Catalog No: AG01DR4K MDL No:MFCD18629356
Product Description
Catalog Number:
AG01DR4K
Chemical Name:
5-AMINO-3-BENZYL-1-ETHYL-1,2,3,4-TETRAHYDROPYRIMIDINE-2,4-DIONE
CAS Number:
1340269-19-3
Molecular Formula:
C13H15N3O2
Molecular Weight:
245.2771
MDL Number:
MFCD18629356
IUPAC Name:
5-amino-3-benzyl-1-ethylpyrimidine-2,4-dione
InChI:
InChI=1S/C13H15N3O2/c1-2-15-9-11(14)12(17)16(13(15)18)8-10-6-4-3-5-7-10/h3-7,9H,2,8,14H2,1H3
InChI Key:
ANSAOHRRBMIJFP-UHFFFAOYSA-N
SMILES:
CCn1cc(N)c(=O)n(c1=O)Cc1ccccc1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.282g/mol
Monoisotopic Mass:
245.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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