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76377-79-2 | Ethyl 5-hydroxy-7-oxo-2-phenyl-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
CAS No: 76377-79-2 Catalog No: AG0055KB MDL No:MFCD17011961
Product Description
Catalog Number:
AG0055KB
Chemical Name:
Ethyl 5-hydroxy-7-oxo-2-phenyl-8-propyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
CAS Number:
76377-79-2
Molecular Formula:
C19H19N3O4
Molecular Weight:
353.3719
MDL Number:
MFCD17011961
IUPAC Name:
ethyl 5-hydroxy-7-oxo-2-phenyl-8-propylpyrido[2,3-d]pyrimidine-6-carboxylate
InChI:
InChI=1S/C19H19N3O4/c1-3-10-22-17-13(15(23)14(18(22)24)19(25)26-4-2)11-20-16(21-17)12-8-6-5-7-9-12/h5-9,11,23H,3-4,10H2,1-2H3
InChI Key:
SQKIAZZCKMOZGL-UHFFFAOYSA-N
SMILES:
CCCn1c2nc(ncc2c(c(c1=O)C(=O)OCC)O)c1ccccc1
Properties
Complexity:
571
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.138g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.378g/mol
Monoisotopic Mass:
353.138g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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