4488-1932 Screening compound: N-{6-tert-butyl-3-[(4-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

4488-1932 Screening compound: N-{6-tert-butyl-3-[(4-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
4488-1932 Screening compound: N-{6-tert-butyl-3-[(4-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4488-1932
N-{6-tert-butyl-3-[(4-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

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

4488-1932

Molecular Formula

C26H30N2O4S (C26 H30 N2 O4 S)

Compound Name

N-{6-tert-butyl-3-[(4-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

IUPAC name

N-{6-tert-butyl-3-[(4-ethoxyphenyl)carbamoyl]-4567-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

SMILES

CCOc(cc1)ccc1NC(c1c(NC(c2ccco2)=O)sc(C2)c1CCC2C(C)(C)C)=O

InChI

InChI=1S/C26H30N2O4S/c1-5-31-18-11-9-17(10-12-18)27-24(30)22-19-13-8-16(26(2,3)4)15-21(19)33-25(22)28-23(29)20-7-6-14-32-20/h6-7,9-12,14,16H,5,8,13,15H2,1-4H3,(H,27,30)(H,28,29)/t16-/m1/s1

InChI Key

ZCNQLPMXPAZRPH-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD03017439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.241

Distribution Coefficient, logD

5.526

Water Solubility, LogSw

-5.49

Polar Surface Area

61.838

Acid Dissociation Constant (pKa)

6.78

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

4488-1932 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4488-1932 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4488-1932?
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What is the minimum amount of 4488-1932 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4488-1932
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4488-1932
  • 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 4488-1932 available by request