CompoundList

Bendamustine dodecyl ester

Also known as Dodecyl 4-(5-(bis(2-chloroethyl)amino)-1-methyl-benzimidazol-2-yl)butanoate, 1H-Benzimidazole-2-butanoic acid, 5-(bis(2-chloroethyl)amino)-1-methyl-, dodecyl ester, RXDX 107

CAS 1456608-94-8Formula C28H45Cl2N3O2Molar mass 526.59 g/mol
Bendamustine dodecyl ester chemical structure, C28H45Cl2N3O2, CAS 1456608-94-8
2D chemical structure

Key facts

What buyers check first

CAS number
1456608-94-8
Formula
C28H45Cl2N3O2
Molar mass
526.59 g/mol
HS code
293399
Category
Screening compounds

What is Bendamustine dodecyl ester?

Plain description, key identifiers and synonyms

Bendamustine-containing Nanoparticle-based Formulation RXDX-107 is a nanoparticle-based formulation containing the alkyl ester of bendamustine, a bifunctional mechlorethamine derivative, encapsulated in human serum albumin (HSA), with potential alkylating and antineoplastic activities. Upon administration of the alkyl ester bendamustine-containing nanoparticle formulation RXDX-107, the nanoparticle formulation permits high concentrations of the alkyl ester of bendamustine be localized at the tumor site. The modified bendamustine alkylates and crosslinks macromolecules, resulting in DNA, RNA and protein synthesis inhibition, and, subsequently, apoptosis.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
dodecyl 4-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]butanoate
CAS number
1456608-94-8
Molecular formula
C28H45Cl2N3O2
UNII
22C7JIO84O
InChIKey
RJNURICEBYUKHL-UHFFFAOYSA-N
InChI
InChI=1S/C28H45Cl2N3O2/c1-3-4-5-6-7-8-9-10-11-12-22-35-28(34)15-13-14-27-31-25-23-24(16-17-26(25)32(27)2)33(20-18-29)21-19-30/h16-17,23H,3-15,18-22H2,1-2H3
SMILES (canonical and isomeric)
CCCCCCCCCCCCOC(=O)CCCC1=NC2=C(N1C)C=CC(=C2)N(CCCl)CCCl

Synonyms

  • Dodecyl 4-(5-(bis(2-chloroethyl)amino)-1-methyl-benzimidazol-2-yl)butanoate
  • 1H-Benzimidazole-2-butanoic acid, 5-(bis(2-chloroethyl)amino)-1-methyl-, dodecyl ester
  • RXDX 107
  • Bendamustine-containing Nanoparticle-based Formulation RXDX-107
  • RXDX-107
  • dodecyl 4-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]butanoate

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
526.59 g/molcalc.
Exact mass
525.2889 Dacalc.
LogP (octanol/water)
7.64calc.
Topological polar surface area
47.36 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
20calc.
Heavy atoms
35calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.71calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Fails (2 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, c1ccc2[nH]cnc2c1

c1ccc2[nH]cnc2c1

2 rings, 9 atoms, the Benzimidazole ring system.

8,995 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.

Bendamustine dodecyl ester suppliers

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Bendamustine dodecyl ester 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

Roles

  • antineoplastic agent
  • pharmaceutical

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 Bendamustine dodecyl ester is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Bendamustine dodecyl ester, based on the data on this page

What is Bendamustine dodecyl ester?

Bendamustine-containing Nanoparticle-based Formulation RXDX-107 is a nanoparticle-based formulation containing the alkyl ester of bendamustine, a bifunctional mechlorethamine derivative, encapsulated in human serum albumin (HSA), with potential alkylating and antineoplastic activities.

What is the CAS number of Bendamustine dodecyl ester?

The CAS registry number of Bendamustine dodecyl ester is 1456608-94-8.

What is the molecular formula and weight of Bendamustine dodecyl ester?

The molecular formula of Bendamustine dodecyl ester is C28H45Cl2N3O2 and its molar mass is 526.59 g/mol.

What is Bendamustine dodecyl ester used for?

Known uses and roles of Bendamustine dodecyl ester include building blocks in research and laboratory, screening compounds in research and laboratory, antineoplastic agent and pharmaceutical.

Is Bendamustine dodecyl ester hazardous?

No GHS hazard classification for Bendamustine dodecyl ester 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 Bendamustine dodecyl ester?

Bendamustine dodecyl ester is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bendamustine dodecyl ester?

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

What is the price of Bendamustine dodecyl ester?

Suppliers quote Bendamustine dodecyl ester 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 Bendamustine dodecyl ester

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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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