E786-0508 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

E786-0508 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide
E786-0508 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E786-0508
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

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

E786-0508

Molecular Formula

C24H26N2O6S (C24 H26 N2 O6 S)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(1-cyclopropanecarbonyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]propanamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-3-[(1-cyclopropanecarbonyl-2-methyl-23-dihydro-1H-indol-5-yl)sulfonyl]propanamide

SMILES

CC(C1)N(C(C2CC2)=O)c(cc2)c1cc2S(CCC(NCc(cc1)cc2c1OCO2)=O)(=O)=O

InChI

InChI=1S/C24H26N2O6S/c1-15-10-18-12-19(5-6-20(18)26(15)24(28)17-3-4-17)33(29,30)9-8-23(27)25-13-16-2-7-21-22(11-16)32-14-31-21/h2,5-7,11-12,15,17H,3-4,8-10,13-14H2,1H3,(H,25,27)/t15-/m1/s1

InChI Key

NFZJRSJYUBPFSJ-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD14918631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.352

Distribution Coefficient, logD

2.352

Water Solubility, LogSw

-3.03

Polar Surface Area

85.731

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

E786-0508 in Drug Discovery

Included in Screening Libraries

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 E786-0508 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E786-0508?
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What is the minimum amount of E786-0508 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E786-0508
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E786-0508
  • 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 E786-0508 available by request