Basic information
- Standard SMILES
c1cnc2c(c1)CCCC2N(Cc1ccc(CNCc2nc3ccccc3[nH]2)cc1)Cc1nc2ccccc2[nH]1- InChIKey
VKWLOTXCCSNCBD-UHFFFAOYSA-N- Molecular formula
- C33H33N7
- Average molar mass
- 527.7 g/mol
Names & identifiers
- Preferred name
- (1H-Benzimidazol-2-ylmethyl)-(4-{[(1H-benzimidazol-2-ylmethyl)-amino]-methyl}-benzyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine
- IUPAC
- N-(1H-benzimidazol-2-ylmethyl)-N-[[4-[(1H-benzimidazol-2-ylmethylamino)methyl]phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
Names & synonyms
SCHEMBL4063485VKWLOTXCCSNCBD-UHFFFAOYSA-N(1H-Benzimidazol-2-ylmethyl)-(4-{[(1H-benzimidazol-2-ylmethyl)-amino]-methyl}-benzyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amine
Database identifiers
- PubChem CID
- 22018638
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 85.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 787
Related reactions
1 records
Compound notes
Loading…