N-[4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]phenyl]pyridine-2-carboxamide

HCID 10184809
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Basic information

Standard SMILES
O=C(Nc1ccc(CN(Cc2nc3ccccc3[nH]2)C2CCCc3cccnc32)cc1)c1ccccn1
InChIKey
NITSTTAMDWAHOS-UHFFFAOYSA-N
Molecular formula
C30H28N6O
Average molar mass
488.6 g/mol
Monoisotopic mass
488.23245954

Names & identifiers

Preferred name
N-[4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]phenyl]pyridine-2-carboxamide
IUPAC
N-[4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]phenyl]pyridine-2-carboxamide

Names & synonyms

CHEMBL1092253SCHEMBL14207351NITSTTAMDWAHOS-UHFFFAOYSA-NN-[4-[[1H-benzimidazol-2-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]phenyl]pyridine-2-carboxamidepyridine-2-carboxylic acid (4-{[(1H-benzoimidazol-2-ylmethyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amino]-methyl}-phenyl)-amide

Database identifiers

PubChem CID
10184809
ChEMBL
CHEMBL1092253

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
86.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
37

Related reactions

2 records
New reaction record

Linked notes

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