2-Methylnaphtho[2,3-D]thiazole

C₁₂H₉NSCAS 6957-25-1199.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₉NS
Molar mass: 199.27 g/mol
Exact mass: 199.0456 Da
logP: 3.76Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

6957-25-1

SMILES

Cc1nc2cc3ccccc3cc2s1

InChIKey

VEDVLCBGJDVXTE-UHFFFAOYSA-N

InChI

InChI=1S/C12H9NS/c1-8-13-11-6-9-4-2-3-5-10(9)7-12(11)14-8/h2-7H,1H3

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Names and synonyms

3 names

Naphtho[2,3-d]thiazole, 2-methyl-
NSC 66161
2-Methylnaphtho[2,3-d][1,3]thiazole

Work with 2-Methylnaphtho[2,3-D]thiazole

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-Methylbenzothiazole120-75-260 % similar 2-Methyl-5-phenylbenzothiazole71215-89-959 % similar 2,5,6-Trimethylbenzothiazole5683-41-058 % similar 2,6-Dimethylbenzothiazole2941-71-155 % similar 2,5-Dimethylbenzothiazole95-26-155 % similar 5-Chloro-2-methylbenzothiazole1006-99-151 % similar 5-Amino-2-methylbenzothiazole13382-43-951 % similar 5-Fluoro-2-methylbenzothiazole399-75-751 % similar

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

Same formula

3-Dibenzothiophenamine25288-76-0 2-Methylnaphtho[1,2-D]thiazole2682-45-3 Phenothiazine92-84-2

Elsewhere

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