General Information of the Compound
Compound ID
CP0031625
Compound Name
10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)phenothiazine;hydrochloride
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Synonyms
10-(3-(4-Methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)phenothiazine
10-(3-(4-methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)-10H-phenothiazine
10-(3-(4-methyl-1-piperazinyl)propyl)-2-(trifluoromethyl)-phenothiazine
10-(gamma-(N'-Methylpiperazino)propyl)-2-trifluoromethylphenothiazine
10-[3-(4-METHYL-PIPERAZIN-1-YL)-PROPYL]-2-TRIFLUOROMETHYL-10H-PHENOTHIAZINE
10-[3-(4-Methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)-10H-phenothiazine
10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)-10H-phenothiazine
10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine
10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine dihydrochloride
2-Trifluoromethyl-10-(3'-(1-methyl-4-piperazinyl)propyl)phenothiazine
Apo-Trifluoperazine
Apo-trifluoperazine (TN)
Calmazine
Eskazine
Eskazine (TN)
Eskazinyl (TN)
Fluoperazine
Flurazine
Jatroneural (TN)
Modalina
Modalina (TN)
NCI17474
Novo-Trifluzine
PMS Trifluoperazine
RP 7623
SKF 5019
Stelazine
Stelazine (*Dihydrochloride*)
Stelazine (TN)
Stelazine Concentrate
Stellazine
TFP
Terfluzine (TN)
Trifluoperaz (TN)
Trifluoperazin
Trifluoperazina
Trifluoperazina [INN-Spanish]
Trifluoperazina [Italian]
Trifluoperazine
Trifluoperazine (INN)
Trifluoperazine HCl
Trifluoperazine [INN:BAN]
Trifluoperazine dihydrochloride
Trifluoperazinum
Trifluoperazinum [INN-Latin]
Trifluoromethyl-10-(3'-(1-methyl-4-piperazinyl)propyl)phenothiazine
Trifluoromethylperazine
Trifluoroperazine
Trifluoroperazine dihydrochloride
Trifluperazine
Triflurin
Trifluroperizine
Triftazin
Triftazine
Triperazine
Tripfluoperazine Hydrochloride
Triphtazin
Triphtazine
Triphthasine
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Structure
Formula
C21H24F3N3S
Molecular Weight
407.505
Canonical SMILES
CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
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InChI
InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3
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InChIKey
ZEWQUBUPAILYHI-UHFFFAOYSA-N
CAS
117-89-5
Physicochemical Property
logP
4.9456
Rotatable Bonds
4
Heavy Atom Count
28
Polar Areas
9.72
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Complexity
28

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 5566
SID: 14904043
ChEMBL ID
CHEMBL422
DrugBank ID
DB00831
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01546, ATP-dependent translocase ABCB1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000167 NIH-3T3-G185 Mus musculus (Mouse)  3
1
IC50 = 6300 nM
   TI
   LI
   LO
   TS
2
IC50 = 7200 nM
   TI
   LI
   LO
   TS
3
IC50 = 10900 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 6500 nM
Protein ID: PT06109, Geminin
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000015 SW480 Homo sapiens (Human)  1
1
Potency ~ 29092.9 nM
   TI
   LI
   LO
   TS
Protein ID: PT01065, Serine/threonine-protein kinase mTOR
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL001056 MEF-1 [Mouse fibroblast] Mus musculus (Mouse)  1
1
Potency = 16481.6 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Trifluoperazine )
Drug Name Trifluoperazine
Company GlaxoSmithKline plc
Indication
Schizophrenia
Approved