2-Methyl-4,5-diphenylthiazole

C16H13NSCAS 3755-83-7251.35 g/mol

Open in Covalent MOL file
NS

Properties

Molecular formula
C16H13NS
Molar mass
251.35 g/mol
Exact mass
251.0769 Da
Melting point
51–52 °C
Boiling point
132 °C (at 0.15 Torr)
logP
4.79Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
3755-83-7
SMILES
Cc1nc(-c2ccccc2)c(-c2ccccc2)s1
InChIKey
ZFYWCVZNRMSXBT-UHFFFAOYSA-N
InChI
InChI=1S/C16H13NS/c1-12-17-15(13-8-4-2-5-9-13)16(18-12)14-10-6-3-7-11-14/h2-11H,1H3

Weigh it out

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

Names and synonyms

4 names
  • Thiazole, 2-methyl-4,5-diphenyl-
  • 4,5-Diphenyl-2-methylthiazole
  • NSC 59791
  • 2-Methyl-4,5-diphenyl-1,3-thiazole

Work with 2-Methyl-4,5-diphenylthiazole

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

2-Methyl-5-phenylbenzothiazole71215-89-947 % similar 2-Methylbenzothiazole120-75-242 % similar 2,3-Diphenylquinoxaline1684-14-640 % similar 2,3,4,5-Tetraphenylthiophene1884-68-040 % similar 3-Methyl-2-phenylpyridine10273-90-239 % similar 2-Methylnaphtho[2,3-d]thiazole6957-25-138 % similar 2-Chloro-3-phenylquinoxaline7065-92-137 % similar 2,6-Diphenylpyridine3558-69-837 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook