Basic information
- CAS
6145-88-6- Standard SMILES
CCc1ccccc1NC1=C(Cl)C(=O)N(c2ccccc2C)C1=O- InChIKey
PNKSKSVKSDRVDM-UHFFFAOYSA-N- Molecular formula
- C19H17ClN2O2
- Average molar mass
- 340.8 g/mol
- Monoisotopic mass
- 340.0978555
Names & identifiers
- Preferred name
- 3-Chloro-4-[(2-ethylphenyl)amino]-1-(2-methylphenyl)-1h-pyrrole-2,5-dione
- IUPAC
- 3-chloro-4-(2-ethylanilino)-1-(2-methylphenyl)pyrrole-2,5-dione
Names & synonyms
6145-88-63-chloro-4-[(2-ethylphenyl)amino]-1-(2-methylphenyl)-1h-pyrrole-2,5-dioneDTXSID909770153-chloro-4-(2-ethylanilino)-1-(2-methylphenyl)pyrrole-2,5-dione3-Chloro-4-(2-ethylanilino)-1-(2-methylphenyl)-1H-pyrrole-2,5-dioneAKOS002346390
Database identifiers
- CAS
6145-88-6- PubChem CID
- 720385
- DTXSID
DTXSID90977015
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 545
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…