4,5,6,7-Tetrahydro-2-benzothiazolamine
Properties
- Molecular formula
- C7H10N2S
- Molar mass
- 154.23 g/mol
- Exact mass
- 154.0565 Da
- Melting point
- 87–88 °C
- Boiling point
- 100 °C
- logP
- 1.43Crippen estimate
- Polar surface area
- 39.6 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Identifiers
CAS number
2933-29-1SMILES
N=c1[nH]c2c(s1)CCCC2InChIKey
SMWAOXCEPHEGFV-UHFFFAOYSA-NInChI
InChI=1S/C7H10N2S/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H2,(H2,8,9)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- 2-Benzothiazolamine, 4,5,6,7-tetrahydro-
- Benzothiazole, 2-amino-4,5,6,7-tetrahydro-
- 2-Amino-4,5-tetramethylenethiazole
- 2-Amino-4,5,6,7-tetrahydrobenzothiazole
- 4,5,6,7-Tetrahydrobenzothiazol-2-amine
- 4,5,6,7-Tetrahydro-1,3-benzothiazol-2-amine
- NSC 45351
- (4,5,6,7-Tetrahydrobenzothiazol-2-yl)amine
- 4,5,6,7-Tetrahydrobenzo[d]thiazol-2-amine
- (4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)amine
- 5,6,7,8-Tetrahydrobenzothiazole-2-amine
- 4,5,6,7-Tetrahydro-1,3-benzothiazole-2-amine
Work with 4,5,6,7-Tetrahydro-2-benzothiazolamine
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
4,5,6,7-Tetrahydro-2,6-benzothiazolediamine104617-49-450 % similar
(6S)-4,5,6,7-Tetrahydro-2,6-benzothiazolediamine106092-09-550 % similar
Pramipexole104632-26-045 % similar
Dexpramipexole104632-28-245 % similar
Domin36085-73-145 % similar
Pramipexole dihydrochloride104632-25-942 % similar
Pramipexole dihydrochloride monohydrate191217-81-939 % similar
N-[(6S)-2-Amino-4,5,6,7-tetrahydro-6-benzothiazolyl]propanamide106006-84-238 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds