General Information of the Compound
| Compound ID |
CP0152345
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| Compound Name |
2-[4-[(3Z)-3-(2-chloranylthioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol;hydrochloride
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| Synonyms |
(Z)-4-(3-(2-Chlorothioxanthen-9-ylidene)propyl)-1-piperazineethanol
2-[4-[(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol
2-{4-[(3Z)-3-(2-chloro-10H-dibenzo[b,e]thiopyran-10-ylidene)propyl]piperazin-1-yl}ethanol
2-{4-[3-(2-chloro-10H-dibenzo[b,e]thiopyran-10-ylidene)propyl]piperazin-1-yl}ethanol
4-(3-(2-Chlorothioxanthen-9-ylidene)propyl)-1-piperazineethanol
Acuphase
Acuphase (TN)
Alpha Clopenthixol
Alpha-Clopenthixol
CLOPENTHIXOL
Cisordinol
Cisordinol (TN)
Clopenthixol (USAN)
Clopenthixolum
Clopentixol
Clopixol
Clopixol (TN)
Zuclopenthixol
Zuclopenthixol (INN)
Zuclopenthixol [BAN:INN]
Zuclopenthixolum
Zuclopenthixolum [Latin]
Zuclopentixol
Zuclopentixol [Spanish]
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| Structure |
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| Formula |
C22H25ClN2OS
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| Molecular Weight |
400.975
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| Canonical SMILES |
OCCN1CCN(CC\C=C2\c3ccccc3Sc3ccc(Cl)cc23)CC1
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| InChI |
InChI=1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-2,4-8,16,26H,3,9-15H2/b18-5-
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| InChIKey |
WFPIAZLQTJBIFN-DVZOWYKESA-N
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| CAS |
53772-83-1
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| 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
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Map of Molecular Bioactivity Related to the Compound
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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 |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound