1482-0005 Screening compound: 2-[(2-methylphenyl)methyl]butanedioic acid

1482-0005 Screening compound: 2-[(2-methylphenyl)methyl]butanedioic acid
1482-0005 Screening compound: 2-[(2-methylphenyl)methyl]butanedioic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1482-0005
2-[(2-methylphenyl)methyl]butanedioic 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

1482-0005

Molecular Formula

C12H14O4 (C12 H14 O4)

Compound Name

2-[(2-methylphenyl)methyl]butanedioic acid

IUPAC name

2-[(2-methylphenyl)methyl]butanedioic acid

SMILES

Cc1c(CC(CC(O)=O)C(O)=O)cccc1

InChI

InChI=1S/C12H14O4/c1-8-4-2-3-5-9(8)6-10(12(15)16)7-11(13)14/h2-5,10H,6-7H2,1H3,(H,13,14)(H,15,16)/t10-/m1/s1

InChI Key

WFWVINOHIVDSEV-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD01029363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

222.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.083

Distribution Coefficient, logD

-1.891

Water Solubility, LogSw

-1.50

Polar Surface Area

57.030

Acid Dissociation Constant (pKa)

4.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

1482-0005 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1482-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1482-0005?
Check Price and Availability of 1482-0005, 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 1482-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1482-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1482-0005
  • 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 1482-0005 available by request