N-(4-(4-(3-(3-(tert-Butyl)-1-(p-tolyl)-1H-pyrazol-5-yl)ureido)-1-naphthoyl)pyridin-2-yl)-2-(2-methoxyethoxy)acetamide

HCID 54589301
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COCCOCC(=O)Nc1cc(C(=O)c2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc23)ccn1
InChIKey
BKRNFAWOCPIBDW-UHFFFAOYSA-N
Molecular formula
C36H38N6O5
Average molar mass
634.7 g/mol
Monoisotopic mass
634.29036833

Names & identifiers

Preferred name
N-(4-(4-(3-(3-(tert-Butyl)-1-(p-tolyl)-1H-pyrazol-5-yl)ureido)-1-naphthoyl)pyridin-2-yl)-2-(2-methoxyethoxy)acetamide
IUPAC
N-[4-[4-[[3-tert-butyl-1-(4-methylphenyl)pyrazol-5-yl]carbamoylamino]naphthalene-1-carbonyl]-2-pyridinyl]-2-(2-methoxyethoxy)acetamide

Names & synonyms

SCHEMBL2593826BKRNFAWOCPIBDW-UHFFFAOYSA-NN-(4-(4-(3-(3-(tert-Butyl)-1-(p-tolyl)-1H-pyrazol-5-yl)ureido)-1-naphthoyl)pyridin-2-yl)-2-(2-methoxyethoxy)acetamide

Database identifiers

PubChem CID
54589301

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
136 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
12
Heavy atoms
47

Related reactions

1 records
New reaction record

Compound notes

Loading…