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Acetophenazine

CAT: 1410-M35370-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Acetophenazine is an anxiolytic compound that is used in the study of depression.
CAS Number
2751-68-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
411.56
Molecular Formula
C23H29N3O2S
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Acetophenazine

Acetophenazine is a member of the class of phenothiazines that is 10H-phenothiazine substituted by a 3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl group at the nitogen atom and an acetyl group at position 2. It has a role as a phenothiazine antipsychotic drug. It is a member of phenothiazines, a N-alkylpiperazine and a N-(2-hydroxyethyl)piperazine. It is functionally related to a 10H-phenothiazine.

CAS Number2751-68-0
PubChem CID17676
IUPAC Name1-[10-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]phenothiazin-2-yl]ethanone
Molecular FormulaC23H29N3O2S
Molecular Weight411.6
XLogP2.6
Topological Polar Surface Area72.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity540
SMILES
CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO
InChI
InChI=1S/C23H29N3O2S/c1-18(28)19-7-8-23-21(17-19)26(20-5-2-3-6-22(20)29-23)10-4-9-24-11-13-25(14-12-24)15-16-27/h2-3,5-8,17,27H,4,9-16H2,1H3
InChIKey
WNTYBHLDCKXEOT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetophenazine
CAS: 2751-68-0
CID: 17676
Formula: C23H29N3O2S
MW: 411.6
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight411.6
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass411.19804835
Monoisotopic Mass411.19804835
Topological Polar Surface Area72.3 Ų
Heavy Atom Count29
Formal Charge0
Complexity540
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BUP01572-01Acetophenazine
MBS3614695-01Acetophenazine dimaleate
HY-B1262-01Acetophenazine (dimaleate)
TRC-A163932-10MGAcetophenazine-d4 Dimaleate
HY-W741434-01Acetophenazine dimaleate-d4
HY-116916S-01Acetophenazine-d4 (dimaleate)

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