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16357-95-2 | 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-bis(4-chlorophenyl)-5-ethyl-
CAS No: 16357-95-2 Catalog No: AG001U8L MDL No:
Product Description
Catalog Number:
AG001U8L
Chemical Name:
2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-bis(4-chlorophenyl)-5-ethyl-
CAS Number:
16357-95-2
Molecular Formula:
C18H14Cl2N2O3
Molecular Weight:
377.2214
IUPAC Name:
1,3-bis(4-chlorophenyl)-5-ethyl-1,3-diazinane-2,4,6-trione
InChI:
InChI=1S/C18H14Cl2N2O3/c1-2-15-16(23)21(13-7-3-11(19)4-8-13)18(25)22(17(15)24)14-9-5-12(20)6-10-14/h3-10,15H,2H2,1H3
InChI Key:
RYGKGTFFEUXNHP-UHFFFAOYSA-N
SMILES:
CCC1C(=O)N(c2ccc(cc2)Cl)C(=O)N(C1=O)c1ccc(cc1)Cl
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.038g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
377.221g/mol
Monoisotopic Mass:
376.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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