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320418-27-7 | 4-(allylamino)-6-(4-chlorophenyl)-2-(4-pyridinyl)-5-pyrimidinecarbonitrile
CAS No: 320418-27-7 Catalog No: AG01FOQA MDL No:
Product Description
Catalog Number:
AG01FOQA
Chemical Name:
4-(allylamino)-6-(4-chlorophenyl)-2-(4-pyridinyl)-5-pyrimidinecarbonitrile
CAS Number:
320418-27-7
IUPAC Name:
4-(4-chlorophenyl)-6-(prop-2-enylamino)-2-pyridin-4-ylpyrimidine-5-carbonitrile
InChI:
InChI=1S/C19H14ClN5/c1-2-9-23-19-16(12-21)17(13-3-5-15(20)6-4-13)24-18(25-19)14-7-10-22-11-8-14/h2-8,10-11H,1,9H2,(H,23,24,25)
InChI Key:
HQJGZBOXBMKVNU-UHFFFAOYSA-N
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.094g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.806g/mol
Monoisotopic Mass:
347.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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