N-[(2-chloro-1-methylindol-3-yl)methylideneamino]-4-nitroaniline
Basic information
- CAS
64209-09-2- Standard SMILES
Cn1c(Cl)c(C=NNc2ccc([N+](=O)[O-])cc2)c2ccccc21- InChIKey
ATIXJGWBSGPRKN-UHFFFAOYSA-N- Molecular formula
- C16H13ClN4O2
- Average molar mass
- 328.75 g/mol
- Monoisotopic mass
- 328.0727034
Names & identifiers
- Preferred name
- N-[(2-chloro-1-methylindol-3-yl)methylideneamino]-4-nitroaniline
- IUPAC
- N-[(2-chloro-1-methylindol-3-yl)methylideneamino]-4-nitroaniline
Names & synonyms
64209-09-2N-[(2-chloro-1-methylindol-3-yl)methylideneamino]-4-nitroanilineDTXSID503132532-Chloro-1-methyl-3-{[2-(4-nitrophenyl)hydrazinylidene]methyl}-1H-indole
Database identifiers
- CAS
64209-09-2- PubChem CID
- 320450
- DTXSID
DTXSID50313253
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 75.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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