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1164564-77-5 | (2E)-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-3-phenylprop-2-en-1-one
CAS No: 1164564-77-5 Catalog No: AG00ISDU MDL No:MFCD02081944
Product Description
Catalog Number:
AG00ISDU
Chemical Name:
(2E)-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-3-phenylprop-2-en-1-one
CAS Number:
1164564-77-5
Molecular Formula:
C19H15NOS
Molecular Weight:
305.3935
MDL Number:
MFCD02081944
IUPAC Name:
1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-3-phenylprop-2-en-1-one
InChI:
InChI=1S/C19H15NOS/c1-14-18(17(21)13-12-15-8-4-2-5-9-15)22-19(20-14)16-10-6-3-7-11-16/h2-13H,1H3
InChI Key:
CARWTLHYUZGUDZ-UHFFFAOYSA-N
SMILES:
O=C(c1sc(nc1C)c1ccccc1)/C=C/c1ccccc1
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.087g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.395g/mol
Monoisotopic Mass:
305.087g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.1
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