200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 823792-98-9
823792-98-9 | 1-Butanone, 1-[2-(2-hydroxyphenyl)-4-(4-morpholinyl)-5-pyrimidinyl]-
CAS No: 823792-98-9 Catalog No: AG0053ES MDL No:
Product Description
Catalog Number:
AG0053ES
Chemical Name:
1-Butanone, 1-[2-(2-hydroxyphenyl)-4-(4-morpholinyl)-5-pyrimidinyl]-
CAS Number:
823792-98-9
Molecular Formula:
C18H21N3O3
Molecular Weight:
327.3776
IUPAC Name:
1-[2-(2-hydroxyphenyl)-4-morpholin-4-ylpyrimidin-5-yl]butan-1-one
InChI:
InChI=1S/C18H21N3O3/c1-2-5-15(22)14-12-19-17(13-6-3-4-7-16(13)23)20-18(14)21-8-10-24-11-9-21/h3-4,6-7,12,23H,2,5,8-11H2,1H3
InChI Key:
KEKSQBTXVDEMLU-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1cnc(nc1N1CCOCC1)c1ccccc1O
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.158g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.384g/mol
Monoisotopic Mass:
327.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.