Basic information
- CAS
153260-24-3- Standard SMILES
Nc1nc2c(s1)CC[C@@H]1NCCC[C@@H]21- InChIKey
BAHUCMQZRKBOSK-RQJHMYQMSA-N- Molecular formula
- C10H15N3S
- Average molar mass
- 209.31 g/mol
- Monoisotopic mass
- 209.09866866
Names & identifiers
- Preferred name
- trans-4,5,5a,6,7,8,9,9a-Octahydrothiazolo(4,5-f)quinolin-2-amine
- IUPAC
- (5aS,9aR)-4,5,5a,6,7,8,9,9a-octahydro-[1,3]thiazolo[4,5-f]quinolin-2-amine
- English name
- trans-4,5,5a,6,7,8,9,9a-Octahydrothiazolo(4,5-f)quinolin-2-amine
- Molecular formula
- C10H15N3S
- Molecular weight
- 209.31
Names & synonyms
trans-4,5,5a,6,7,8,9,9a-Octahydrothiazolo(4,5-f)quinolin-2-amine153260-24-3H23G951FGC4,5,5a,6,7,8,9,9a-Octahydro thiazolo(4,5-f)quinolin-2-amine, trans-CCRIS 6700UNII-H23G951FGCTRANS-4,5,5A,6,7,8,9,9A-OCTAHYDROTHIAZOLO[4,5-F]QUINOLIN-2-AMINE(5aS,9aR)-4,5,5a,6,7,8,9,9a-octahydro-[1,3]thiazolo[4,5-f]quinolin-2-amineSCHEMBL10666367DTXSID80165303Q27279533trans-4,5,5a,6,7,8,9,9a-octahydro thiazolo(4,5-f)quinolin-2-amine
Show more names
Thiazolo[4,5-f]quinolin-2-amine, 4,5,5a,6,7,8,9,9a-octahydro-, trans- (9CI)
(5aS,9aR)-4,5,5a,6,7,8,9,9a-Octahydro[1,3]thiazolo[4,5-f]quinolin-2-amineTHIAZOLO(4,5-F)QUINOLIN-2-AMINE, 4,5,5A,6,7,8,9,9A-OCTAHYDRO-, TRANS-
Database identifiers
- CAS
153260-24-3- PubChem CID
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 79.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 223
Physicochemical properties
- FDA UNII
- 23 G951FGC · H23G951FGC
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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