GW842166
2-(2,4-dichloroanilino)-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
Molecular Identity
GW842166
2-(2,4-dichloroanilino)-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide
PubChem CID: 10253143
5-pyrimidinecarboxamide, 2-[(2,4-dichlorophenyl)amino]-n-[(tetrahydro-2h-pyran-4-yl)methyl]-4-(trifluoromethyl)- is a dichlorobenzene.
2D Structure
Properties
C18H17Cl2F3N4O2
Molecular Formula
449.30
Molecular Weight
g/mol
448.0681
Exact Mass
Da
4.1
XLogP
Drug-like (Lipinski: < 5)
76.1
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
8
H-Bond Acceptors
552
Complexity
SMILES
Canonical SMILES
SMILES: C1COCCC1CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=C(C=C(C=C3)Cl)ClIsomeric SMILES
SMILES: C1COCCC1CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=C(C=C(C=C3)Cl)ClSynonyms(20)
666260-75-9GW842166XGW 842166XGW842166GW-842,166XGW 842166GW-842166VL1I6P2DZ82-(2,4-Dichloroanilino)-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamidecompound 35 [PMID: 17477516]DTXSID60216786GW8-42166XGW8-421665-Pyrimidinecarboxamide, 2-((2,4-dichlorophenyl)amino)-N-((tetrahydro-2H-pyran-4-yl)methyl)-4-(trifluoromethyl)-compound 35 (PMID: 17477516)
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to GW842166
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