8014-9487 Screening compound: (2Z)-2-[(4-methoxyphenyl)formamido]-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide

8014-9487 Screening compound: (2Z)-2-[(4-methoxyphenyl)formamido]-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide
8014-9487 Screening compound: (2Z)-2-[(4-methoxyphenyl)formamido]-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9487
(2Z)-2-[(4-methoxyphenyl)formamido]-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide

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

8014-9487

Molecular Formula

C28H27N3O3 (C28 H27 N3 O3)

Compound Name

(2Z)-2-[(4-methoxyphenyl)formamido]-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide

IUPAC name

(2Z)-2-[(4-methoxyphenyl)formamido]-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-phenylprop-2-enamide

SMILES

Cc1c(CCNC(/C(/NC(c(cc2)ccc2OC)=O)=C/c2ccccc2)=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C28H27N3O3/c1-19-23(24-10-6-7-11-25(24)30-19)16-17-29-28(33)26(18-20-8-4-3-5-9-20)31-27(32)21-12-14-22(34-2)15-13-21/h3-15,18,30H,16-17H2,1-2H3,(H,29,33)(H,31,32)

InChI Key

GJAWJKKRJWQPKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03821163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.387

Distribution Coefficient, logD

3.625

Water Solubility, LogSw

-4.44

Polar Surface Area

63.888

Acid Dissociation Constant (pKa)

6.72

Base Dissociation Constant (pKb)

-2.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

8014-9487 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8014-9487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9487?
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What is the minimum amount of 8014-9487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9487
  • 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 8014-9487 available by request