E230-0742 Screening compound: 4-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]butanamide

E230-0742 Screening compound: 4-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]butanamide
E230-0742 Screening compound: 4-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E230-0742
4-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]butanamide

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

E230-0742

Molecular Formula

C25H30N2O2 (C25 H30 N2 O2)

Compound Name

4-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]butanamide

IUPAC name

4-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]butanamide

SMILES

Cc1ccc(Cn2c(cccc3)c3c(CCCC(NCC3OCCC3)=O)c2)cc1

InChI

InChI=1S/C25H30N2O2/c1-19-11-13-20(14-12-19)17-27-18-21(23-8-2-3-9-24(23)27)6-4-10-25(28)26-16-22-7-5-15-29-22/h2-3,8-9,11-14,18,22H,4-7,10,15-17H2,1H3,(H,26,28)/t22-/m1/s1

InChI Key

GCFZXEZMDODAPJ-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD14850530

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.53

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.744

Distribution Coefficient, logD

3.744

Water Solubility, LogSw

-3.77

Polar Surface Area

34.825

Acid Dissociation Constant (pKa)

13.25

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

E230-0742 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with E230-0742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E230-0742?
Check Price and Availability of E230-0742, 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 E230-0742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E230-0742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E230-0742
  • 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 E230-0742 available by request