1-Phenylamino-4-chlorophthalazine
Basic information
- CAS
87166-49-2- Standard SMILES
Clc1nnc(Nc2ccccc2)c2ccccc12- InChIKey
DNFHFIHSDFNNJW-UHFFFAOYSA-N- Molecular formula
- C14H10ClN3
- Average molar mass
- 255.7 g/mol
- Monoisotopic mass
- 255.056325
Names & identifiers
- Preferred name
- 1-Phenylamino-4-chlorophthalazine
- IUPAC
- 4-chloro-N-phenylphthalazin-1-amine
Names & synonyms
87166-49-21-phenylamino-4-chlorophthalazineNSC150545SCHEMBL10338919DTXSID001007372AKOS009144059NSC-1505454-Chloro-N-phenylphthalazin-1(2H)-imine
Database identifiers
- CAS
87166-49-2- PubChem CID
- 289097
- DTXSID
DTXSID001007372
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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