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Home > Thiazole > 1421262-08-9
1421262-08-9 | 1,3-Bis[4-(4-hydroxyphenyl)-2-thiazolyl]benzene
CAS No: 1421262-08-9 Catalog No: AG01ETTE MDL No:MFCD22682976
Product Description
Catalog Number:
AG01ETTE
Chemical Name:
1,3-Bis[4-(4-hydroxyphenyl)-2-thiazolyl]benzene
CAS Number:
1421262-08-9
Molecular Formula:
C24H16N2O2S2
Molecular Weight:
428.5260
MDL Number:
MFCD22682976
IUPAC Name:
4-[2-[3-[4-(4-hydroxyphenyl)-1,3-thiazol-2-yl]phenyl]-1,3-thiazol-4-yl]phenol
InChI:
InChI=1S/C24H16N2O2S2/c27-19-8-4-15(5-9-19)21-13-29-23(25-21)17-2-1-3-18(12-17)24-26-22(14-30-24)16-6-10-20(28)11-7-16/h1-14,27-28H
InChI Key:
BAVUOVQMFPDJEE-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1csc(n1)c1cccc(c1)c1scc(n1)c1ccc(cc1)O
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
428.065g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
428.524g/mol
Monoisotopic Mass:
428.065g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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