N-[5-(4,4-Dimethyl-2,5-dioxo-3-pyridin-4-ylmethyl-imidazolidin-1-yl)-2-trifluoromethoxy-phenyl]-2-(4,4-dimethyl-piperidin-1-yl)-acetamide

HCID 11613655

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CC1(C)CCN(CC(=O)Nc2cc(N3C(=O)N(Cc4ccncc4)C(C)(C)C3=O)ccc2OC(F)(F)F)CC1
InChIKey: BNFCZPXPLHFMOY-UHFFFAOYSA-N
Molecular formula: C27H32F3N5O4
Average molar mass: 547.6 g/mol

Names & identifiers

Preferred name: N-[5-(4,4-Dimethyl-2,5-dioxo-3-pyridin-4-ylmethyl-imidazolidin-1-yl)-2-trifluoromethoxy-phenyl]-2-(4,4-dimethyl-piperidin-1-yl)-acetamide
IUPAC: N-[5-[4,4-dimethyl-2,5-dioxo-3-(pyridin-4-ylmethyl)imidazolidin-1-yl]-2-(trifluoromethoxy)phenyl]-2-(4,4-dimethylpiperidin-1-yl)acetamide

Names & synonyms

N-[5-(4,4-Dimethyl-2,5-dioxo-3-pyridin-4-ylmethyl-imidazolidin-1-yl)-2-trifluoromethoxy-phenyl]-2-(4,4-dimethyl-piperidin-1-yl)-acetamideSCHEMBL1129762

Database identifiers

PubChem CID: 11613655

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 95.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 9
Rotatable bonds: 7
Heavy atoms: 39
Formal charge: 0
Complexity: 912

Related reactions

2 records

New reaction record

HRID 2132628As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

HRID 2356936As productuspto-grants-2010_07

Compound notes

Loading…