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674348-07-3 | 2,4-Imidazolidinedione, 5-ethyl-5-[[(phenylmethyl)thio]methyl]-, (5R)-
CAS No: 674348-07-3 Catalog No: AG005O47 MDL No:
Product Description
Catalog Number:
AG005O47
Chemical Name:
2,4-Imidazolidinedione, 5-ethyl-5-[[(phenylmethyl)thio]methyl]-, (5R)-
CAS Number:
674348-07-3
Molecular Formula:
C13H16N2O2S
Molecular Weight:
264.3433
IUPAC Name:
(5R)-5-(benzylsulfanylmethyl)-5-ethylimidazolidine-2,4-dione
InChI:
InChI=1S/C13H16N2O2S/c1-2-13(11(16)14-12(17)15-13)9-18-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H2,14,15,16,17)/t13-/m0/s1
InChI Key:
MSGRKPOOVOQIRA-ZDUSSCGKSA-N
SMILES:
CC[C@@]1(CSCc2ccccc2)NC(=O)NC1=O
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
264.093g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.343g/mol
Monoisotopic Mass:
264.093g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
83.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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