Perazine Sulfoxide

CAT: 0024-sc-396298Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-396298Size:2 mg

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CAS Number

20627-44-5

Chemical Information

Perazine sulfoxide

CAS Number	20627-44-5
PubChem CID	159893
IUPAC Name	10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine 5-oxide
Molecular Formula	C20H25N3OS
Molecular Weight	355.5
XLogP	2.7
Topological Polar Surface Area	56.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	25
Formal Charge	0
Complexity	440

SMILES

CN1CCN(CC1)CCCN2C3=CC=CC=C3S(=O)C4=CC=CC=C42

InChI

InChI=1S/C20H25N3OS/c1-21-13-15-22(16-14-21)11-6-12-23-17-7-2-4-9-19(17)25(24)20-10-5-3-8-18(20)23/h2-5,7-10H,6,11-16H2,1H3

InChIKey

QGGFCTLXKUUQAT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20627-44-5

CID: 159893

Formula: C20H25N3OS

MW: 355.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	355.5
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	355.17183360
Monoisotopic Mass	355.17183360
Topological Polar Surface Area	56.7 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	440
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-219574	Perazine-d8
sc-397436	Phenothiazinyl Perazine
sc-212537	Perazine Dihydrochloride
sc-478692	1′-Oxo Perazine-d8
sc-396422	1′-Oxo Perazine
sc-501107	4-Chloro Perazine-d8
sc-499781	N-Desmethyl Perazine-d8
sc-501106	4-Chloro Perazine Dihydrochloride
sc-499779	N-Desmethyl Perazine Dimalonic Acid Salt
sc-391299	Vamidothion Sulfoxide

Catalog	Name
AR-P32642-01	Perazine Sulfoxide
RM-P150304-01	Prochlorperazine Impurity 4; Perazine Sulfoxide
T202362-01	Perazine dimalonate
AR-P02869-01	Perazine DiHCl
019278	Perazine Dihydrochloride
HY-132494S-01	Perazine-d8
286779-01	Phenothiazinyl perazine
286123-01	1'-Oxo perazine
WDC60016-01	4-Chloro perazine-d8
019012	1’-Oxo Perazine