(6R)-4,5,6,7-Tetrahydro-1,3-benzothiazole-2,6-diamine

C₇H₁₁N₃SCAS 106092-11-9169.25 g/mol

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Properties

Molecular formula: C₇H₁₁N₃S
Molar mass: 169.25 g/mol
Exact mass: 169.0674 Da
logP: 0.54Crippen estimate
Polar surface area: 64.9 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 0
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

106092-11-9

SMILES

C1CC2=C(C[C@@H]1N)SC(=N2)N

InChIKey

DRRYZHHKWSHHFT-SCSAIBSYSA-N

InChI

InChI=1S/C7H11N3S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h4H,1-3,8H2,(H2,9,10)/t4-/m1/s1

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Names and synonyms

1 names

(+)-(6R)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole

Work with (6R)-4,5,6,7-Tetrahydro-1,3-benzothiazole-2,6-diamine

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-Amino-6-(propylamino)-5,6-dihydrobenzo[D]thiazol-7(4H)-one1286047-33-333 % similar

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

Same formula

4,5,6,7-Tetrahydro-2,6-benzothiazolediamine104617-49-4 (6S)-4,5,6,7-Tetrahydro-2,6-benzothiazolediamine106092-09-5 1-(2-Thiazolyl)piperazine42270-37-1

Elsewhere

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