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74038-65-6 | 5-cyclohexyl-5-(thiolan-3-yl)imidazolidine-2,4-dione
CAS No: 74038-65-6 Catalog No: AG005I79 MDL No:
Product Description
Catalog Number:
AG005I79
Chemical Name:
5-cyclohexyl-5-(thiolan-3-yl)imidazolidine-2,4-dione
CAS Number:
74038-65-6
Molecular Formula:
C13H20N2O2S
Molecular Weight:
268.3751
IUPAC Name:
5-cyclohexyl-5-(thiolan-3-yl)imidazolidine-2,4-dione
InChI:
InChI=1S/C13H20N2O2S/c16-11-13(15-12(17)14-11,10-6-7-18-8-10)9-4-2-1-3-5-9/h9-10H,1-8H2,(H2,14,15,16,17)
InChI Key:
GOJUOPOQMGDIHD-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(N1)(C1CCCCC1)C1CSCC1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.125g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
268.375g/mol
Monoisotopic Mass:
268.125g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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