Basic information
- Standard SMILES
CC(CN1CCCC1)N1c2ccccc2Sc2ccc(C(=O)O)cc21- InChIKey
UMGSJSGJFGNXSL-UHFFFAOYSA-N- Molecular formula
- C20H22N2O2S
- Average molar mass
- 354.5 g/mol
Names & identifiers
- Preferred name
- 10-(1-Pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carboxylic acid
- IUPAC
- 10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carboxylic acid
Names & synonyms
SCHEMBL9760059
Database identifiers
- PubChem CID
- 14536637
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 482
Related reactions
3 records
Linked notes
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