Basic information
- CAS
65189-78-8- Standard SMILES
COc1ccc2c(c1)c(CC(=O)OCC(C(=O)O)c1ccccc1)c(C)n2C(=O)c1ccc(Cl)cc1- InChIKey
UCCJWNPWWPJKGL-UHFFFAOYSA-N- Molecular formula
- C28H24ClNO6
- Average molar mass
- 505.9 g/mol
- Monoisotopic mass
- 505.1292152
Overview
Tropesin is a N-acylindole.
Names & identifiers
- Preferred name
- Tropesin
- IUPAC
- 3-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxy-2-phenylpropanoic acid
- English name
- TROPESIN
- Molecular formula
- C28H24ClNO6
- Molecular weight
- 505.952
Names & synonyms
TropesinRepanidal65189-78-8P8NV2308A2DTXSID409837671H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 2-carboxy-2-phenylethyl esterindomethacin alpha-carboxyphenethyl ester2-carboxy-2-phenylethyl 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetateRefChem:933570DTXCID001410997VUFB-120183-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxy-2-phenylpropanoic acid
Show more names
Tropesin (unspecified)2-Phenyl-2-carboxyethyl 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-3-indolylacetate
Tropesin (+-)-Vufb 120183-({[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl}oxy)-2-phenylpropanoic acidVUFB12018EINECS 265-607-7UNII-P8NV2308A265828-79-7TROPESIN [MI]
Database identifiers
- CAS
65189-78-8、65828-79-7- PubChem CID
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 94.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 778
Physicochemical properties
- FDA UNII
- 8 NV2308A2 · P8NV2308A2
Chemistry & industry
Additional notes
DefinitionChEBI: Tropesin is a N-acylindole.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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