200,000+ products from a single source!
sales@angenechem.com
823793-17-5 | 1-Butanone, 1-[4-(dimethylamino)-2-(2-hydroxyphenyl)-5-pyrimidinyl]-
CAS No: 823793-17-5 Catalog No: AG004Y95 MDL No:
Product Description
Catalog Number:
AG004Y95
Chemical Name:
1-Butanone, 1-[4-(dimethylamino)-2-(2-hydroxyphenyl)-5-pyrimidinyl]-
CAS Number:
823793-17-5
Molecular Formula:
C16H19N3O2
Molecular Weight:
285.3410
IUPAC Name:
1-[4-(dimethylamino)-2-(2-hydroxyphenyl)pyrimidin-5-yl]butan-1-one
InChI:
InChI=1S/C16H19N3O2/c1-4-7-13(20)12-10-17-15(18-16(12)19(2)3)11-8-5-6-9-14(11)21/h5-6,8-10,21H,4,7H2,1-3H3
InChI Key:
UKMVQHCEMKZFAY-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1cnc(nc1N(C)C)c1ccccc1O
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.148g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.347g/mol
Monoisotopic Mass:
285.148g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.