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137363-58-7 | 2(3H)-Thiazolone, 3,5-bis(phenylmethyl)-
CAS No: 137363-58-7 Catalog No: AG00136M MDL No:
Product Description
Catalog Number:
AG00136M
Chemical Name:
2(3H)-Thiazolone, 3,5-bis(phenylmethyl)-
CAS Number:
137363-58-7
Molecular Formula:
C17H15NOS
Molecular Weight:
281.3721
IUPAC Name:
3,5-dibenzyl-1,3-thiazol-2-one
InChI:
InChI=1S/C17H15NOS/c19-17-18(12-15-9-5-2-6-10-15)13-16(20-17)11-14-7-3-1-4-8-14/h1-10,13H,11-12H2
InChI Key:
LGKXTRPXRPNJCW-UHFFFAOYSA-N
SMILES:
O=c1sc(cn1Cc1ccccc1)Cc1ccccc1
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.087g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.373g/mol
Monoisotopic Mass:
281.087g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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