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87102-31-6 | 2H-Thiazolo[3,2-a]-1,3,5-triazine, 3,4-dihydro-2,4,6-triphenyl-
CAS No: 87102-31-6 Catalog No: AG008FLD MDL No:
Product Description
Catalog Number:
AG008FLD
Chemical Name:
2H-Thiazolo[3,2-a]-1,3,5-triazine, 3,4-dihydro-2,4,6-triphenyl-
CAS Number:
87102-31-6
Molecular Formula:
C23H19N3S
Molecular Weight:
369.4821
IUPAC Name:
2,4,6-triphenyl-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazine
InChI:
InChI=1S/C23H19N3S/c1-4-10-17(11-5-1)20-16-27-23-25-21(18-12-6-2-7-13-18)24-22(26(20)23)19-14-8-3-9-15-19/h1-16,21-22,24H
InChI Key:
RPXSPSIDSDKSIP-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1N=c2scc(n2C(N1)c1ccccc1)c1ccccc1
Properties
Complexity:
568
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.13g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
369.486g/mol
Monoisotopic Mass:
369.13g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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