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23569-79-1 | 1,2,4-Triazine, 1,2,5,6-tetrahydro-1,6-dimethyl-3,5-diphenyl-
CAS No: 23569-79-1 Catalog No: AG002NOJ MDL No:
Product Description
Catalog Number:
AG002NOJ
Chemical Name:
1,2,4-Triazine, 1,2,5,6-tetrahydro-1,6-dimethyl-3,5-diphenyl-
CAS Number:
23569-79-1
Molecular Formula:
C17H19N3
Molecular Weight:
265.3529
IUPAC Name:
1,6-dimethyl-3,5-diphenyl-5,6-dihydro-2H-1,2,4-triazine
InChI:
InChI=1S/C17H19N3/c1-13-16(14-9-5-3-6-10-14)18-17(19-20(13)2)15-11-7-4-8-12-15/h3-13,16H,1-2H3,(H,18,19)
InChI Key:
SDAXPVZJYBXMLV-UHFFFAOYSA-N
SMILES:
CN1NC(=NC(C1C)c1ccccc1)c1ccccc1
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.158g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.36g/mol
Monoisotopic Mass:
265.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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