Basic information
- CAS
3819-00-9- Standard SMILES
CC(=O)c1ccc2c(c1)N(CCCN1CCC(CCO)CC1)c1ccccc1S2- InChIKey
BTFMCMVEUCGQDX-UHFFFAOYSA-N- Molecular formula
- C24H30N2O2S
- Average molar mass
- 410.6 g/mol
- Monoisotopic mass
- 410.20279938
Overview
1-[10-[3-[4-(2-hydroxyethyl)-1-piperidinyl]propyl]-2-phenothiazinyl]ethanone is a member of phenothiazines.
Names & identifiers
- Preferred name
- Piperacetazine
- IUPAC
- 1-[10-[3-[4-(2-hydroxyethyl)piperidin-1-yl]propyl]phenothiazin-2-yl]ethanone
- English name
- PIPERACETAZINE (250 MG)
- Molecular formula
- C24H30N2O2S
- Molecular weight
- 410.57
Names & synonyms
PIPERACETAZINE3819-00-9QuidePiperacetazinaPC-1421PiperacetazinumDTXSID7023481NSC-760067KL6248WNW410-(3-(4-(2-Hydroxyethyl)piperidino)propyl)phenothiazin-2-yl methyl ketone1-[10-[3-[4-(2-Hydroxyethyl)-1-piperidinyl]propyl]-10H-phenothiazin-2-yl]ethanoneEthanone, 1-(10-(3-(4-(2-hydroxyethyl)-1-piperidinyl)propyl)-10H-phenothiazin-2-yl)-
Show more names
ethan-2-yl)-SC-9794PIPERACETAZINE (250 MG)Piperacetazine (1541000)
DTXCID9034811-(10-(3-(4-(2-Hydroxyethyl)-1-piperidinyl)propyl)-10H-phenothiazin-2-yl)ethanone10-[3-[4-(2-hydroxyethyl)piperidino]propyl]phenothiazin-2-yl methyl ketoneEthanone, 1-[10-[3-[4-(2-hydroxyethyl)-1-piperidinyl]propyl]-10H-phenothiazin-2-yl]-1-(10-{3-[4-(2-hydroxyethyl)-1-piperidinyl]propyl}-10H-phenothiazin-2-yl)ethanoneRefChem:57753223-312-0Psymod
Database identifiers
- CAS
3819-00-9
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 537
Experimental & physicochemical properties
DrugsDEA NFLIS-Drug Category -> Depressants and Tranquilizers
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Physicochemical properties
- Melting point
- 99 °C · 99°C
- Boiling point
- 606.4 · 606.4±55.0 °C(Predicted)
- Density
- 1.0802 · 1.0802 (rough estimate)
- refractive index
- 1.636 · 1.6360 (estimate)
- storage temp.
- Refrigerator
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 15.1 · 15.10±0.10(Predicted)
- color
- Pale Yellow to Yellow
- FDA UNII
- 6248 WNW4 · KL6248WNW4
- Symbol(GHS)
- 7 · GHS07
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (100%)
Toxicology
Drug Induced Liver Injury
Drug-Induced Liver Injury Severity and Toxicity (DILIst)
Piperacetazine
DILI Positive
DOI:10.1016/j.drudis.2019.09.022
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
UsesAntipsychotic.
UsesPiperacetazine is an antipsychotic drug which can be used to decrease the effect of stimulants.
Suppliers39 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海微佳禾生物科技有限公司17502176150; 17502176150 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
北京博奥森生物技术有限公司400-901-9800 18611424007 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
BOC Sciences
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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