Basic information
- CAS
7489-66-9- Standard SMILES
CN(C)CCOC(=O)c1ccc2[nH]c3c(c2c1)CSCC3- InChIKey
WNDHLINIYZAWCR-UHFFFAOYSA-N- Molecular formula
- C16H20N2O2S
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.12454906
Overview
Tipindole is a small molecule drug. Tipindole has a monoisotopic molecular weight of 304.12 Da.
Names & identifiers
- Preferred name
- Tipindole
- IUPAC
- 2-(dimethylamino)ethyl 1,3,4,5-tetrahydrothiopyrano[4,3-b]indole-8-carboxylate
- English name
- Tipindole
- Molecular formula
- C16H20N2O2S
- Molecular weight
- 304.41
Names & synonyms
Tipindole7489-66-9TipindolTipindolumUS65H9WBNHDTXSID70225869typindol1,3,4,5-Tetrahydrothiopyrano(4,3-b)indole-8-carboxylic acid, 2-(dimethylamino)ethyl esterRefChem:190104DTXCID50148360Tipindole [INN]2-(dimethylamino)ethyl 1,3,4,5-tetrahydrothiopyrano[4,3-b]indole-8-carboxylate
Show more names
1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid2-(dimethylaminoethyl)1,3,4,5-Tetrahydrothiopyrano[4,3-b]indole-8-carboxylic acid 2-(dimethylamino)ethyl esterThiopyrano[4,3-b]indole-8-carboxylic acid, 1,3,4,5-tetrahydro-, 2-(dimethylamino)ethyl ester
MLS000766700Tipindol [INN-Spanish]Tipindolum [INN-Latin]SMR000339596UNII-US65H9WBNH2-(Dimethylamino)ethyl 1,3,4,5-tetrahydrothiopyrano(4,3-b)indole-8-carboxylateChemDiv3_000133Oprea1_217221
Database identifiers
- CAS
7489-66-9- PubChem CID
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 377
Physicochemical properties
- FDA UNII
- 65 H9WBNH · US65H9WBNH
Chemistry & industry
Applications
UsesTipindole is a serotonin antagonist. Tipindole can be used in depression research[1].
Suppliers2 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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