Basic information
- CAS
144339-80-0- Standard SMILES
C1=C(c2c[nH]c3ccc(-c4nccs4)cc23)CCNC1- InChIKey
VBGDVIFQUUEIBC-UHFFFAOYSA-N- Molecular formula
- C16H15N3S
- Average molar mass
- 281.4 g/mol
- Monoisotopic mass
- 281.09866866
Names & identifiers
- Preferred name
- 3-(1,2,3,6-Tetrahydropyridin-4-yl)-5-(1,3-thiazol-2-yl)-1H-indole
- IUPAC
- 2-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]-1,3-thiazole
Names & synonyms
144339-80-03-(1,2,3,6-Tetrahydropyridin-4-yl)-5-(1,3-thiazol-2-yl)-1H-indoleSCHEMBL9094872DTXSID40602183
Database identifiers
- CAS
144339-80-0- PubChem CID
- 20076873
- DTXSID
DTXSID40602183
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 69 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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