Basic information
- CAS
78069-91-7- Standard SMILES
Nc1cnccc1N1CCN(c2ccc(Cl)c(Cl)c2)CC1- InChIKey
IEGZBBYTQVVRKA-UHFFFAOYSA-N- Molecular formula
- C15H16Cl2N4
- Average molar mass
- 323.2 g/mol
- Monoisotopic mass
- 322.0752019
Names & identifiers
- Preferred name
- Piperazine, 1-(3-amino-4-pyridyl)-4-(3,4-dichlorophenyl)-
- IUPAC
- 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]pyridin-3-amine
Names & synonyms
BRN 4537551Piperazine, 1-(3-amino-4-pyridyl)-4-(3,4-dichlorophenyl)-78069-91-73-Pyridinamine, 4-(4-(3,4-dichlorophenyl)-1-piperazinyl)-DTXSID90228711NSC 147895RefChem:372239DTXCID401512024-[4-(3,4-dichlorophenyl)piperazin-1-yl]pyridin-3-amineNSC147895NSC-147895
Database identifiers
- CAS
78069-91-7- PubChem CID
- 98552
- DTXSID
DTXSID90228711
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 45.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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