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Home > Imidazoles > 142979-87-1
142979-87-1 | 2,4-Imidazolidinedione,5,5-bis[[(4-pyridinylmethyl)thio]methyl]-
CAS No: 142979-87-1 Catalog No: AG006X2B MDL No:
Product Description
Catalog Number:
AG006X2B
Chemical Name:
2,4-Imidazolidinedione,5,5-bis[[(4-pyridinylmethyl)thio]methyl]-
CAS Number:
142979-87-1
Molecular Formula:
C17H18N4O2S2
Molecular Weight:
374.4804
IUPAC Name:
5,5-bis(pyridin-4-ylmethylsulfanylmethyl)imidazolidine-2,4-dione
InChI:
InChI=1S/C17H18N4O2S2/c22-15-17(21-16(23)20-15,11-24-9-13-1-5-18-6-2-13)12-25-10-14-3-7-19-8-4-14/h1-8H,9-12H2,(H2,20,21,22,23)
InChI Key:
PGFKRAPIGHYLOW-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)NC1(CSCc1ccncc1)CSCc1ccncc1
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.087g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
374.477g/mol
Monoisotopic Mass:
374.087g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
135A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| 5,5-disubstituted hydantoins: syntheses and anti-HIV activity. | Journal of medicinal chemistry 19920918 |
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