Y043-8236 Screening compound: 4-(2-methyl-1H-1,3-benzimidazol-1-yl)butanoic acid

Y043-8236 Screening compound: 4-(2-methyl-1H-1,3-benzimidazol-1-yl)butanoic acid
Y043-8236 Screening compound: 4-(2-methyl-1H-1,3-benzimidazol-1-yl)butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-8236
4-(2-methyl-1H-1,3-benzimidazol-1-yl)butanoic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y043-8236

Molecular Formula

C12H14N2O2 (C12 H14 N2 O2)

Compound Name

4-(2-methyl-1H-1,3-benzimidazol-1-yl)butanoic acid

IUPAC name

4-(2-methyl-1H-13-benzodiazol-1-yl)butanoic acid

SMILES

Cc1nc(cccc2)c2n1CCCC(O)=O

InChI

InChI=1S/C12H14N2O2/c1-9-13-10-5-2-3-6-11(10)14(9)8-4-7-12(15)16/h2-3,5-6H,4,7-8H2,1H3,(H,15,16)

InChI Key

IRBRKNDBYUBKIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00879013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

218.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.161

Distribution Coefficient, logD

-1.449

Water Solubility, LogSw

-1.71

Polar Surface Area

39.578

Acid Dissociation Constant (pKa)

4.79

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

Y043-8236 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cancer
  • Immune system
  • Nervous system
  • Cardiovascular
Structure:
  • Fragments
Targets:
  • Others
  • Ion Channels

References: we are preparing a list of scientific research reports with Y043-8236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-8236?
Check Price and Availability of Y043-8236, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y043-8236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-8236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-8236
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y043-8236 available by request