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864377-31-1 | 2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine
CAS No: 864377-31-1 Catalog No: AG004N0E MDL No:MFCD22200060
Product Description
Catalog Number:
AG004N0E
Chemical Name:
2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine
CAS Number:
864377-31-1
Molecular Formula:
C21H14BrN3
Molecular Weight:
388.2600
MDL Number:
MFCD22200060
IUPAC Name:
2-(3-bromophenyl)-4,6-diphenyl-1,3,5-triazine
InChI:
InChI=1S/C21H14BrN3/c22-18-13-7-12-17(14-18)21-24-19(15-8-3-1-4-9-15)23-20(25-21)16-10-5-2-6-11-16/h1-14H
InChI Key:
HNZUKQQNZRMNGS-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)c1nc(nc(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.037g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.268g/mol
Monoisotopic Mass:
387.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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