pipotiazine   

GtoPdb Ligand ID: 7557

Synonyms: Piportil® | pipothiazine
pipotiazine is an approved drug (UK (1980))
Compound class: Synthetic organic
Comment: Pipotiazine is a phenothiazine class typical antipsychotic.
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 97.77
Molecular weight 475.2
XLogP 3.78
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES OCCC1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C
Isomeric SMILES OCCC1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)S(=O)(=O)N(C)C
InChI InChI=1S/C24H33N3O3S2/c1-25(2)32(29,30)20-8-9-24-22(18-20)27(21-6-3-4-7-23(21)31-24)14-5-13-26-15-10-19(11-16-26)12-17-28/h3-4,6-9,18-19,28H,5,10-17H2,1-2H3
InChI Key JOMHSQGEWSNUKU-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
Approved drug? Yes (UK (1980))
IUPAC Name
10-[3-[4-(2-hydroxyethyl)piperidin-1-yl]propyl]-N,N-dimethylphenothiazine-2-sulfonamide
International Nonproprietary Names
INN number INN
3046 pipotiazine
Synonyms
Piportil® | pipothiazine
Comments
Pipotiazine is a phenothiazine class typical antipsychotic.
Database Links
CAS Registry No. 39860-99-6
ChEMBL Ligand CHEMBL398880
DrugBank Ligand DB01621
GtoPdb PubChem SID 223365893
PubChem CID 62867
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Wikipedia Pipotiazine