2,2'-Thiobis(1H-isoindole-1,3(2H)-dione)

C16H8N2O4SCAS 7764-29-6324.31 g/mol

Open in Covalent MOL file
OONSNOO
AmideLactam

Properties

Molecular formula
C16H8N2O4S
Molar mass
324.31 g/mol
Exact mass
324.0205 Da
Melting point
190 °C (decomposes)
logP
2.14Crippen estimate
Polar surface area
74.8 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
7764-29-6
SMILES
O=C1c2ccccc2C(=O)N1SN1C(=O)c2ccccc2C1=O
InChIKey
QYIWBOWEQBEAGP-UHFFFAOYSA-N
InChI
InChI=1S/C16H8N2O4S/c19-13-9-5-1-2-6-10(9)14(20)17(13)23-18-15(21)11-7-3-4-8-12(11)16(18)22/h1-8H

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Names and synonyms

7 names
  • 2,2′-Thiobis[1H-isoindole-1,3(2H)-dione]
  • 1H-Isoindole-1,3(2H)-dione, 2,2′-thiobis-
  • Phthalimide, N,N′-thiodi-
  • N,N′-Thiobisphthalimide
  • N,N′-Thiodiphthalimide
  • NSC 75099
  • 2,2′-Thiobis(isoindoline-1,3-dione)

Work with 2,2'-Thiobis(1H-isoindole-1,3(2H)-dione)

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Folpet133-07-359 % similar N-Aminophthalimide1875-48-554 % similar N-Bromophthalimide2439-85-254 % similar N-Chlorophthalimide3481-09-254 % similar N-Hydroxyphthalimide524-38-954 % similar N-Methylphthalimide550-44-754 % similar N-(Hydroxymethyl)phthalimide118-29-654 % similar Cyclohexylthiophthalimide17796-82-653 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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