Basic information
- CAS
18235-91-1- Standard SMILES
CCOC(=O)c1c(C)n(-c2ccccc2C)c2ccc(OCC[NH+](CC)CC)cc12.[Cl-]- InChIKey
PWUIHKRKYDIBLL-UHFFFAOYSA-N- Molecular formula
- C25H33ClN2O3
- Average molar mass
- 445 g/mol
- Monoisotopic mass
- 444.2179706
Names & identifiers
- Preferred name
- OF 2499
- IUPAC
- 2-[3-ethoxycarbonyl-2-methyl-1-(2-methylphenyl)indol-5-yl]oxyethyl-diethylazanium chloride
Names & synonyms
Of-249918235-91-1OF 2499Indole-3-carboxylic acid, 5-(2-(diethylamino)ethoxy)-2-methyl-1-o-tolyl-, ethyl ester, monohydrochlorideRefChem:366960
Database identifiers
- CAS
18235-91-1- PubChem CID
- 28984
Properties
Computed structural properties
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 538
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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