chempirical

Phenothiazine-10-carbonyl chloride

C13H8ClNOSCAS 18956-87-1261.72 g/mol

Open in Covalent MOL file
OClNS
Acyl halideSulfide

Properties

Molecular formula
C13H8ClNOS
Molar mass
261.72 g/mol
Exact mass
261.0015 Da
Melting point
99 °C
logP
4.65Crippen estimate
Polar surface area
20.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
18956-87-1
SMILES
O=C(Cl)N1c2ccccc2Sc2ccccc21
InChIKey
MJRIZSDRKPPHTK-UHFFFAOYSA-N
InChI
InChI=1S/C13H8ClNOS/c14-13(16)15-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)15/h1-8H

Weigh it out

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

Names and synonyms

4 names
  • 10H-Phenothiazine-10-carbonyl chloride
  • Phenothiazine-N-carbonyl chloride
  • 10-Chlorocarbonylphenothiazine
  • N-(Chlorocarbonyl)phenothiazine

Work with Phenothiazine-10-carbonyl chloride

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

10,11-Dihydro-5H-dibenz[B,F]azepine-5-carbonyl chloride33948-19-558 % similar 5H-Dibenz[B,F]azepine-5-carbonyl chloride33948-22-058 % similar N,N-Diphenylcarbamic chloride83-01-253 % similar 10-Methylphenothiazine1207-72-344 % similar Thianthrene92-85-337 % similar Mequitazine29216-28-236 % similar (±)-Promethazine60-87-733 % similar Trimeprazine tartrate4330-99-833 % similar

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

Elsewhere

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