N-[6-(Acetylamino)pyridin-3-yl]-4-(4-phenyl-1,3-thiazol-2-yl)piperazine-1-carboxamide

HCID 68779653
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)Nc1ccc(NC(=O)N2CCN(c3nc(-c4ccccc4)cs3)CC2)cn1
InChIKey
PKJKXGBQUGVSEG-UHFFFAOYSA-N
Molecular formula
C21H22N6O2S
Average molar mass
422.5 g/mol

Names & identifiers

Preferred name
N-[6-(Acetylamino)pyridin-3-yl]-4-(4-phenyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
IUPAC
N-(6-acetamido-3-pyridinyl)-4-(4-phenyl-1,3-thiazol-2-yl)piperazine-1-carboxamide

Names & synonyms

SCHEMBL3771089PKJKXGBQUGVSEG-UHFFFAOYSA-NN-[6-(Acetylamino)pyridin-3-yl]-4-(4-phenyl-1,3-thiazol-2-yl)piperazine-1-carboxamide

Database identifiers

PubChem CID
68779653

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
119 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

Loading…