2260-3784 Screening compound: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,4-dichlorophenoxy)butanamide

2260-3784 Screening compound: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,4-dichlorophenoxy)butanamide
2260-3784 Screening compound: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,4-dichlorophenoxy)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2260-3784
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,4-dichlorophenoxy)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

2260-3784

Molecular Formula

C23H26Cl2N2O2S (C23 H26 Cl2 N2 O2 S)

Compound Name

N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(2,4-dichlorophenoxy)butanamide

IUPAC name

N-(6-tert-butyl-3-cyano-4567-tetrahydro-1-benzothiophen-2-yl)-4-(24-dichlorophenoxy)butanamide

SMILES

CC(C)(C)C(CC1)Cc2c1c(C#N)c(NC(CCCOc(ccc(Cl)c1)c1Cl)=O)s2

InChI

InChI=1S/C23H26Cl2N2O2S/c1-23(2,3)14-6-8-16-17(13-26)22(30-20(16)11-14)27-21(28)5-4-10-29-19-9-7-15(24)12-18(19)25/h7,9,12,14H,4-6,8,10-11H2,1-3H3,(H,27,28)/t14-/m1/s1

InChI Key

PXISIDDUYFIIDA-CQSZACIVSA-N

MDL Number (MFCD)

MFCD01337017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.422

Distribution Coefficient, logD

5.109

Water Solubility, LogSw

-6.40

Polar Surface Area

47.392

Acid Dissociation Constant (pKa)

6.11

Base Dissociation Constant (pKb)

-4.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.80

2260-3784 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 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 2260-3784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2260-3784?
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What is the minimum amount of 2260-3784 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2260-3784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2260-3784
  • 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 2260-3784 available by request