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101394-27-8 | 2,4(1H,3H)-Pyrimidinedione, dihydro-1-methyl-3-(1-naphthalenyl)-
CAS No: 101394-27-8 Catalog No: AG0004EG MDL No:
Product Description
Catalog Number:
AG0004EG
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, dihydro-1-methyl-3-(1-naphthalenyl)-
CAS Number:
101394-27-8
Molecular Formula:
C15H14N2O2
Molecular Weight:
254.2839
IUPAC Name:
1-methyl-3-naphthalen-1-yl-1,3-diazinane-2,4-dione
InChI:
InChI=1S/C15H14N2O2/c1-16-10-9-14(18)17(15(16)19)13-8-4-6-11-5-2-3-7-12(11)13/h2-8H,9-10H2,1H3
InChI Key:
LXBLGDYZOMEQFF-UHFFFAOYSA-N
SMILES:
CN1CCC(=O)N(C1=O)c1cccc2c1cccc2
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.289g/mol
Monoisotopic Mass:
254.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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