E847-0150 Screening compound: 6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

E847-0150 Screening compound: 6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
E847-0150 Screening compound: 6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound E847-0150
6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic 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

E847-0150

Molecular Formula

C28H30N2O2 (C28 H30 N2 O2)

Compound Name

6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

IUPAC name

6-methyl-3-({[2-(4-methylphenyl)ethyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

SMILES

Cc1ccc(CCNCc2c(C(O)=O)n(Cc3c(C)cccc3)c3c2ccc(C)c3)cc1

InChI

InChI=1S/C28H30N2O2/c1-19-8-11-22(12-9-19)14-15-29-17-25-24-13-10-20(2)16-26(24)30(27(25)28(31)32)18-23-7-5-4-6-21(23)3/h4-13,16,29H,14-15,17-18H2,1-3H3,(H,31,32)

InChI Key

KBMAMSVVCZUDLT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27601939

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.712

Distribution Coefficient, logD

5.712

Water Solubility, LogSw

-5.47

Polar Surface Area

40.484

Acid Dissociation Constant (pKa)

4.47

Base Dissociation Constant (pKb)

10.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

E847-0150 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with E847-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E847-0150?
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What is the minimum amount of E847-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E847-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E847-0150
  • 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 E847-0150 available by request