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189140-06-5 | 2(1H)-Pyrimidinone, 4-amino-1-(3,7,11,15-tetramethylhexadecyl)-
CAS No: 189140-06-5 Catalog No: AG002HYD MDL No:
Product Description
Catalog Number:
AG002HYD
Chemical Name:
2(1H)-Pyrimidinone, 4-amino-1-(3,7,11,15-tetramethylhexadecyl)-
CAS Number:
189140-06-5
Molecular Formula:
C24H45N3O
Molecular Weight:
391.6336
IUPAC Name:
4-amino-1-(3,7,11,15-tetramethylhexadecyl)pyrimidin-2-one
InChI:
InChI=1S/C24H45N3O/c1-19(2)9-6-10-20(3)11-7-12-21(4)13-8-14-22(5)15-17-27-18-16-23(25)26-24(27)28/h16,18-22H,6-15,17H2,1-5H3,(H2,25,26,28)
InChI Key:
FXLLYOKKTDPSCB-UHFFFAOYSA-N
SMILES:
CC(CCCC(CCCC(C)C)C)CCCC(CCn1ccc(nc1=O)N)C
Properties
Complexity:
498
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.356g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
391.644g/mol
Monoisotopic Mass:
391.356g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8
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