General Information of the Compound
| Compound ID |
CP0134204
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
Show/Hide
|
||||||||||||||||||
| Synonyms |
(3E)-3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
(3E)-3-(2-chlorothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
(3Z)-3-(2-chlorothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
(Z)-2-Chloro-9-(omega-dimethylaminopropylidene)thioxanthene
(Z)-2-Chloro-N,N-dimethylthioxanthene-.DELTA.(sup9),(sup.gamma.)-propylamine
(Z)-2-Chloro-N,N-dimethylthioxanthene-delta(sup 9,gamma)-propylamine
(alpha.-2-Chloro-9-.omega.-dimethylamino-propylamine)thioxanthene
2-Chloro-9-[.omega.-(dimethylamino)propylidene]thioxanthene
2-Chloro-9-[3-(dimethylamino)propylidene]thioxanthene
2-Chloro-N,N-dimethylthioxanthene-.delta.(sup 9), .gamma.-propylamine
3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethyl-1-propanamine
3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
3-(2-chlorothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
Alpha-Chlorprothixene
Chloroprothixene
Chlorprothixen
Chlorprothixene
Chlorprothixene (JAN/USAN/INN)
Chlorprothixene [USAN:INN:BAN:JAN]
Chlorprothixenum
Chlorprothixenum [INN-Latin]
Chlorprothixine
Chlorprotixen
Chlorprotixene
Chlorprotixine
Chlothixen
Cis-2-Chloro-9-(3-dimethylaminopropylidene)thioxanthene
Cis-Chlorprothixene
Clorprotisene
Clorprotisene [DCIT]
Clorprotixeno
Clorprotixeno [INN-Spanish]
Cloxan, Taractan, Truxal, Chlorprothixene
Iaractan
MK 184
N 714
N 714C
N-714
NCI56378
Paxyl
Rentovet
Ro 4-0403
Ro-4-0403;Trans(E)-Chlorprothixen
Tactaran
Taractan
Taractan (TN)
Tarasan
Tardan
Thioxanthene-delta9,gamma-propylamine, 2-chloro-N,N-dimethyl-, (Z)-(8CI)
Traquilan
Trictal
Truxal
Truxal (TN)
Truxaletten
Truxil
Vetacalm
{3-[2-Chloro-thioxanthen-(9Z)-ylidene]-propyl}-dimethyl-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H18ClNS
|
||||||||||||||||||
| Molecular Weight |
315.869
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CC\C=C1\c2ccccc2Sc2ccc(Cl)cc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H18ClNS/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18/h3-4,6-10,12H,5,11H2,1-2H3/b14-7-
Show/Hide
|
||||||||||||||||||
| InChIKey |
WSPOMRSOLSGNFJ-AUWJEWJLSA-N
|
||||||||||||||||||
| CAS |
113-59-7
|
||||||||||||||||||
| Physicochemical Property |
"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). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
| DrugBank ID | |||||||||||||||||||
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: PT01195, D(1A) dopamine receptor
Protein ID: PT01169, D(1B) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01206, Histamine H1 receptor
Protein ID: PT01194, Histamine H3 receptor
Protein ID: PT03795, Solute carrier family 22 member 1
Clinical Information about the Compound