chempirical

Fluclotizolam

C15H10ClFN4SCAS 54123-15-8332.78 g/mol

Open in Covalent MOL file
NNNSClNF
Aryl halideImine

Properties

Molecular formula
C15H10ClFN4S
Molar mass
332.78 g/mol
Exact mass
332.0299 Da
logP
3.78Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
54123-15-8
SMILES
CC1=NN=C2N1C3=C(C=C(S3)Cl)C(=NC2)C4=CC=CC=C4F
InChIKey
ZDYRCUZZLRLMHG-UHFFFAOYSA-N
InChI
InChI=1S/C15H10ClFN4S/c1-8-19-20-13-7-18-14(9-4-2-3-5-11(9)17)10-6-12(16)22-15(10)21(8)13/h2-6H,7H2,1H3

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Work with Fluclotizolam

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

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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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