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87296-61-5 | 1-BENZYL-3-DIMETHYLAMINO-QUINAZOLINE-2,4-DIONE
CAS No: 87296-61-5 Catalog No: AG004HYH MDL No:
Product Description
Catalog Number:
AG004HYH
Chemical Name:
1-BENZYL-3-DIMETHYLAMINO-QUINAZOLINE-2,4-DIONE
CAS Number:
87296-61-5
Molecular Formula:
C17H17N3O2
Molecular Weight:
295.3358
IUPAC Name:
1-benzyl-3-(dimethylamino)quinazoline-2,4-dione
InChI:
InChI=1S/C17H17N3O2/c1-18(2)20-16(21)14-10-6-7-11-15(14)19(17(20)22)12-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3
InChI Key:
UGGBZPXSZYNWMS-UHFFFAOYSA-N
SMILES:
CN(n1c(=O)c2ccccc2n(c1=O)Cc1ccccc1)C
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.132g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.342g/mol
Monoisotopic Mass:
295.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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