1-[3,5-Bis(trifluoromethyl)phenyl]-3-[4-(4-fluorophenyl)-1-(1,3-thiazole-2-carbonyl)pyrrolidin-3-yl]-1,3-dimethylurea

HCID 123716601
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Basic information

Standard SMILES
CN(C(=O)N(C)C1CN(C(=O)c2nccs2)CC1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIKey
PFBBOFQQKXKGQC-UHFFFAOYSA-N
Molecular formula
C25H21F7N4O2S
Average molar mass
574.5 g/mol

Names & identifiers

Preferred name
1-[3,5-Bis(trifluoromethyl)phenyl]-3-[4-(4-fluorophenyl)-1-(1,3-thiazole-2-carbonyl)pyrrolidin-3-yl]-1,3-dimethylurea
IUPAC
1-[3,5-bis(trifluoromethyl)phenyl]-3-[4-(4-fluorophenyl)-1-(1,3-thiazole-2-carbonyl)pyrrolidin-3-yl]-1,3-dimethylurea

Database identifiers

PubChem CID
123716601

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
85 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
11
Rotatable bonds
4
Heavy atoms
39

Related reactions

1 records
New reaction record

Linked notes

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