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132352-08-0 | 2H-Pyrazino[1,2-a]pyrimidine, 1,3,4,6,7,9a-hexahydro-9,9a-diphenyl-
CAS No: 132352-08-0 Catalog No: AG0010LH MDL No:
Product Description
Catalog Number:
AG0010LH
Chemical Name:
2H-Pyrazino[1,2-a]pyrimidine, 1,3,4,6,7,9a-hexahydro-9,9a-diphenyl-
CAS Number:
132352-08-0
Molecular Formula:
C19H21N3
Molecular Weight:
291.3901
IUPAC Name:
9,9a-diphenyl-1,2,3,4,6,7-hexahydropyrazino[1,2-a]pyrimidine
InChI:
InChI=1S/C19H21N3/c1-3-8-16(9-4-1)18-19(17-10-5-2-6-11-17)21-12-7-14-22(19)15-13-20-18/h1-6,8-11,21H,7,12-15H2
InChI Key:
MRKJPCPRAVCFOF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1=NCCN2C1(NCCC2)c1ccccc1
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.174g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.398g/mol
Monoisotopic Mass:
291.174g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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