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Basic information
- Standard SMILES
CC(C)CNCCCN1CCN(CCCNc2nc3ccccc3[nH]2)CC1- InChIKey
USNXANLCNXHHPN-UHFFFAOYSA-N- Molecular formula
- C21H36N6
- Average molar mass
- 372.6 g/mol
Names & identifiers
- Preferred name
- (1h-Benzimidazol-2-yl)-{3-[4-(3-isobutylamino-propyl)-piperazin-1-yl]-propyl}-amine
- IUPAC
- N-[3-[4-[3-(2-methylpropylamino)propyl]piperazin-1-yl]propyl]-1H-benzimidazol-2-amine
Names & synonyms
SCHEMBL2444228USNXANLCNXHHPN-UHFFFAOYSA-N(1h-benzimidazol-2-yl)-{3-[4-(3-isobutylamino-propyl)-piperazin-1-yl]-propyl}-amine
Database identifiers
- PubChem CID
- 11675155
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 59.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 396
Related reactions
1 records
Compound notes
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