(4-{4-[5-(6-Trifluoromethyl-pyridin-3-ylamino)-pyrazin-2-yl]-phenyl}-cyclohexyl)-acetic acid methyl ester

HCID 66615921
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Basic information

Standard SMILES
COC(=O)CC1CCC(c2ccc(-c3cnc(Nc4ccc(C(F)(F)F)nc4)cn3)cc2)CC1
InChIKey
JIXVYIYZAQFNIC-UHFFFAOYSA-N
Molecular formula
C25H25F3N4O2
Average molar mass
470.5 g/mol

Names & identifiers

Preferred name
(4-{4-[5-(6-Trifluoromethyl-pyridin-3-ylamino)-pyrazin-2-yl]-phenyl}-cyclohexyl)-acetic acid methyl ester
IUPAC
methyl 2-[4-[4-[5-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyrazin-2-yl]phenyl]cyclohexyl]acetate

Names & synonyms

(4-{4-[5-(6-Trifluoromethyl-pyridin-3-ylamino)-pyrazin-2-yl]-phenyl}-cyclohexyl)-acetic acid methyl esterSCHEMBL181100

Database identifiers

PubChem CID
66615921

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
77 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
7
Heavy atoms
34

Related reactions

4 records
New reaction record

Compound notes

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