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Screening compounds

Iodophenpropit

Also known as 3-(1H-Imidazol-5-yl)propyl N'-(2-(4-iodophenyl)ethyl)imidothiocarbamate, 3-(1H-imidazol-4-yl)propyl N-(2-(4-iodophenyl)ethyl)carbamimidothioate, S-(3-(4(5)-Imidazolyl)propyl)-N-(2-(4-iodophenyl)ethyl)isothiouronium hydrogen sulfate

CAS 145196-88-9Formula C15H19IN4SMolar mass 414.32 g/mol
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Iodophenpropit chemical structure, C15H19IN4S, CAS 145196-88-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
145196-88-9
Formula
C15H19IN4S
Molar mass
414.32 g/mol
HS code
293329
Category
Screening compounds

What is Iodophenpropit?

Plain description, key identifiers and synonyms

N'-[2-(4-iodophenyl)ethyl]carbamimidothioic acid 3-(1H-imidazol-5-yl)propyl ester is an organoiodine compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-(1H-imidazol-5-yl)propyl N'-[2-(4-iodophenyl)ethyl]carbamimidothioate
CAS number
145196-88-9Other or deprecated CAS: 143407-29-8
Molecular formula
C15H19IN4S
UNII
3SH45L9H3Z
InChIKey
UBHYDQAARZKHEZ-UHFFFAOYSA-N
InChI
InChI=1S/C15H19IN4S/c16-13-5-3-12(4-6-13)7-8-19-15(17)21-9-1-2-14-10-18-11-20-14/h3-6,10-11H,1-2,7-9H2,(H2,17,19)(H,18,20)
SMILES (canonical and isomeric)
C1=CC(=CC=C1CCN=C(N)SCCCC2=CN=CN2)I

Synonyms

  • 3-(1H-Imidazol-5-yl)propyl N'-(2-(4-iodophenyl)ethyl)imidothiocarbamate
  • 3-(1H-imidazol-4-yl)propyl N-(2-(4-iodophenyl)ethyl)carbamimidothioate
  • S-(3-(4(5)-Imidazolyl)propyl)-N-(2-(4-iodophenyl)ethyl)isothiouronium hydrogen sulfate
  • Carbamimidothioic acid, N'-(2-(4-iodophenyl)ethyl)-, 3-(1H-imidazol-5-yl)propyl ester
  • 3-(1H-Imidazol-4-yl)propyl (4-iodophenethyl)carbamimidothioate
  • Tocris-0779
  • 3-(1H-imidazol-5-yl)propyl N'-[2-(4-iodophenyl)ethyl]carbamimidothioate
  • 3-(1H-Imidazol-5-yl)propyl N-[2-(4-iodophenyl)ethyl]carbamimidothioate
  • {[3-(1H-imidazol-5-yl)propyl]sulfanyl}-N''''-[2-(4-iodophenyl)ethyl]methanimidamide
  • Carbamimidothioic acid, [2-(4-iodophenyl)ethyl]-,3-(1H-imidazol-4-yl)propyl ester

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
414.32 g/molcalc.
Exact mass
414.0375 Dacalc.
LogP (octanol/water)
3.24calc.
Topological polar surface area
67.06 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
7calc.
Heavy atoms
21calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, C(=NCCc1ccccc1)SCCCc1cnc[nH]1

C(=NCCc1ccccc1)SCCCc1cnc[nH]1

2 rings, 19 atoms.

2 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Iodophenpropit suppliers

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Iodophenpropit price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Pharmacological actions

  • Histamine H3 Antagonists

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Iodophenpropit is traded under.

HS 2933.29Indicative HS code

Compounds containing an unfused imidazole ring (whether or not hydrogenated) in the…

World exports in 2024
$1.43B
−7.6% vs 2023, imports $1.47B
2019 to 2024
Top exporters
  1. China28.1%
  2. France * partner reported12.7%
  3. India * partner reported10.3%
Top importers
  1. United Kingdom13.0%
  2. United States7.9%
  3. China6.5%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Iodophenpropit is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Iodophenpropit, based on the data on this page

What is Iodophenpropit?

N'-[2-(4-iodophenyl)ethyl]carbamimidothioic acid 3-(1H-imidazol-5-yl)propyl ester is an organoiodine compound.

What is the CAS number of Iodophenpropit?

The CAS registry number of Iodophenpropit is 145196-88-9. Other or deprecated CAS numbers: 143407-29-8.

What is the molecular formula and weight of Iodophenpropit?

The molecular formula of Iodophenpropit is C15H19IN4S and its molar mass is 414.32 g/mol.

What is Iodophenpropit used for?

Known uses and roles of Iodophenpropit include building blocks in research and laboratory, screening compounds in research and laboratory and histamine h3 antagonists.

Is Iodophenpropit hazardous?

No GHS hazard classification for Iodophenpropit is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Iodophenpropit?

Iodophenpropit is usually classified under HS code 293329 (Compounds containing an unfused imidazole ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Iodophenpropit?

Post a free request on CompoundList and suppliers of Iodophenpropit will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Iodophenpropit?

Suppliers quote Iodophenpropit on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Iodophenpropit

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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