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Home > Pyridines > 1311254-72-4
1311254-72-4 | Pyrido[4,3-d]pyrimidin-4(4aH)-one, 5,6,7,8-tetrahydro-6-(phenylmethyl)-
CAS No: 1311254-72-4 Catalog No: AG000VKR MDL No:MFCD19382512
Product Description
Catalog Number:
AG000VKR
Chemical Name:
Pyrido[4,3-d]pyrimidin-4(4aH)-one, 5,6,7,8-tetrahydro-6-(phenylmethyl)-
CAS Number:
1311254-72-4
Molecular Formula:
C14H15N3O
Molecular Weight:
241.2884
MDL Number:
MFCD19382512
IUPAC Name:
6-benzyl-4a,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
InChI:
InChI=1S/C14H15N3O/c18-14-12-9-17(7-6-13(12)15-10-16-14)8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2
InChI Key:
UUBYONJHDUREIJ-UHFFFAOYSA-N
SMILES:
O=C1N=CN=C2C1CN(CC2)Cc1ccccc1
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.122g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.294g/mol
Monoisotopic Mass:
241.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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