s-Triazine, 2,4-diamino-6-(1-piperazinyl)-
Basic information
- CAS
21840-23-3- Standard SMILES
Nc1nc(N)nc(N2CCNCC2)n1- InChIKey
KIBBUGBJMBIZHY-UHFFFAOYSA-N- Molecular formula
- C7H13N7
- Average molar mass
- 195.23 g/mol
- Monoisotopic mass
- 195.12324344
Names & identifiers
- Preferred name
- s-Triazine, 2,4-diamino-6-(1-piperazinyl)-
- IUPAC
- 6-piperazin-1-yl-1,3,5-triazine-2,4-diamine
- English name
- 6-(1-Piperazinyl)-1,3,5-triazine-2,4-diamine
- Molecular formula
- C7H13N7
- Molecular weight
- 195.23
Names & synonyms
21840-23-3s-Triazine, 2,4-diamino-6-(1-piperazinyl)-AI3-601052,4-Diamino-6-(1-piperazinyl)-s-triazineDTXSID901762481,3,5-Triazine-2,4-diamine, 6-(1-piperazinyl)-RefChem:379653DTXCID30987396-(piperazin-1-yl)-1,3,5-triazine-2,4-diamineSCHEMBL89625326-(1-Piperazinyl)-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
21840-23-3- PubChem CID
- 210879
- DTXSID
DTXSID90176248- Nikkaji
- J48.134C
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 171
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Compound notes
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