chempirical

Fezolinetant

C16H15FN6OSCAS 1629229-37-3358.40 g/mol

Open in Covalent MOL file
NNNNOFNNS
AmideAryl halide

Properties

Molecular formula
C16H15FN6OS
Molar mass
358.40 g/mol
Exact mass
358.1012 Da
logP
2.46Crippen estimate
Polar surface area
76.8 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

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
1629229-37-3
SMILES
C[C@@H]1C2=NN=C(N2CCN1C(=O)C3=CC=C(C=C3)F)C4=NC(=NS4)C
InChIKey
PPSNFPASKFYPMN-SECBINFHSA-N
InChI
InChI=1S/C16H15FN6OS/c1-9-13-19-20-14(15-18-10(2)21-25-15)23(13)8-7-22(9)16(24)11-3-5-12(17)6-4-11/h3-6,9H,7-8H2,1-2H3/t9-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • (4-Fluorophenyl)-[(8R)-8-methyl-3-(3-methyl-1,2,4-thiadiazol-5-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]methanone
  • ((8R)-5,6-Dihydro-8-methyl-3-(3-methyl-1,2,4-thiadiazol-5-yl)-1,2,4-triazolo(4,3-a)pyrazin-7(8H)-yl)(4-fluorophenyl)methanone
  • Fezolinetantum
  • Veoza
  • Vezoa

Work with Fezolinetant

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

N-(4-Fluorobenzoyl)piperidine58547-67-432 % similar 4-Fluoro-N-methoxy-N-methylbenzamide116332-54-831 % similar ADX 47273851881-60-230 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook