Trazodone EP Impurity H DiHCl

CAT: 1596-AR-T03306-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T03306-01Size:10 Units

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CAS Number

2408971-27-5

Synonyms

1,1'- (1,3-Propanediyl) bis[4- (3-chlorophenyl) piperazine] Dihydrochloride

Molecular Formula

C23H30Cl2N4; 2 (HCl)

Molecular Weight

433.42;2 (36.46)

API Name

Trazodone

Chemical Information

1,3-Bis-[4-(3-chlorophenyl)piperazin-1-yl]propane Dihydrochloride

CAS Number	2408971-27-5
PubChem CID	129318550
IUPAC Name	1-(3-chlorophenyl)-4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]piperazine;dihydrochloride
Molecular Formula	C23H32Cl4N4
Molecular Weight	506.3
Topological Polar Surface Area	13
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	31
Formal Charge	0
Complexity	435

SMILES

C1CN(CCN1CCCN2CCN(CC2)C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)Cl.Cl.Cl

InChI

InChI=1S/C23H30Cl2N4.2ClH/c24-20-4-1-6-22(18-20)28-14-10-26(11-15-28)8-3-9-27-12-16-29(17-13-27)23-7-2-5-21(25)19-23;;/h1-2,4-7,18-19H,3,8-17H2;2*1H

InChIKey

GJACYTIZZHHUSK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2408971-27-5

CID: 129318550

Formula: C23H32Cl4N4

MW: 506.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	506.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	506.135158
Monoisotopic Mass	504.138108
Topological Polar Surface Area	13 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	435
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	3
Compound Is Canonicalized	Yes

Catalog	Name
AR-P10938-01	Trazodone EP Impurity H
AR-T05785-01	Trazodone Impurity 28 DiHCl
AR-N08518-01	Nicergoline EP Impurity H DiHCl
AR-I03945-01	Irinotecan EP Impurity H DiHCl
AR-F01026	Famotidine EP Impurity H DiHCl
AR-T02804-01	Trazodone Impurity 1-d8 DiHCl
AR-T05770-01	Trazodone Impurity 1-d4 DiHCl
AR-I03950-01	Ent-Irinotecan EP Impurity H DiHCl
AR-I03949-01	Rac-Irinotecan EP Impurity H DiHCl
AR-T01141-01	Tamoxifen EP Impurity H (DiHCl salt)

Catalog	Name
CS-O-43062	Trazodone EP Impurity H diHCl
IT171132	Trazodone Impurity A
CS-P-00132	Trazodone Impurity F
CS-P-00128	Trazodone Impurity B
RM-T260454-01	Trazodone Impurity 54
RM-T260450-01	Trazodone Impurity 50
RM-T260443-01	Trazodone Impurity 43
TRC-B494200-25MG	Trazodone Dimeric Impurity
RM-T260401-01	Trazodone Hydrochloride Impurity A; Trazodone N1-Oxide
CS-RS-00089	Trazodone Impurity 28