3,5-Pyridinediamine, 2,2'-(1,4-piperazinediyl)bis-
Basic information
- CAS
72624-39-6- Standard SMILES
Nc1cnc(N2CCN(c3ncc(N)cc3N)CC2)c(N)c1- InChIKey
VYBAWXUKSQVEPT-UHFFFAOYSA-N- Molecular formula
- C14H20N8
- Average molar mass
- 300.36 g/mol
- Monoisotopic mass
- 300.18109267
Names & identifiers
- Preferred name
- 3,5-Pyridinediamine, 2,2'-(1,4-piperazinediyl)bis-
- IUPAC
- 2-[4-(3,5-diamino-2-pyridinyl)piperazin-1-yl]pyridine-3,5-diamine
Names & synonyms
3,5-Pyridinediamine, 2,2'-(1,4-piperazinediyl)bis-72624-39-6G6KV945IABNSC147914UNII-G6KV945IABNSC 1479142,2'-(1,4-Piperazinediyl)bis-3,5-pyridinediamineNSC-147914DTXSID102229532,2'-(Piperazine-1,4-diyl)di(pyridine-3,5-diamine)2-[4-(3,5-diamino-2-pyridyl)piperazin-1-yl]pyridine-3,5-diamine
Database identifiers
- CAS
72624-39-6- PubChem CID
- 287772
- DTXSID
DTXSID10222953- UNII
- G6KV945IAB
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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