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186424-05-5 | 2-Imidazolidinethione,5-phenyl-1-(phenylmethyl)-
CAS No: 186424-05-5 Catalog No: AG007SAN MDL No:
Product Description
Catalog Number:
AG007SAN
Chemical Name:
2-Imidazolidinethione,5-phenyl-1-(phenylmethyl)-
CAS Number:
186424-05-5
Molecular Formula:
C16H16N2S
Molecular Weight:
268.3766
IUPAC Name:
1-benzyl-5-phenylimidazolidine-2-thione
InChI:
InChI=1S/C16H16N2S/c19-16-17-11-15(14-9-5-2-6-10-14)18(16)12-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,17,19)
InChI Key:
GOLHBNRSNIJRCC-UHFFFAOYSA-N
SMILES:
S=C1NCC(N1Cc1ccccc1)c1ccccc1
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.103g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.378g/mol
Monoisotopic Mass:
268.103g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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