T408-1823 Screening compound: 4-[2-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carbonyl]morpholine

T408-1823 Screening compound: 4-[2-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carbonyl]morpholine
T408-1823 Screening compound: 4-[2-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carbonyl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound T408-1823
4-[2-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carbonyl]morpholine

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

T408-1823

Molecular Formula

C19H26N2O3S (C19 H26 N2 O3 S)

Compound Name

4-[2-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophene-5-carbonyl]morpholine

IUPAC name

4-[2-(piperidine-1-carbonyl)-4567-tetrahydro-1-benzothiophene-5-carbonyl]morpholine

SMILES

O=C(C(CC1)Cc2c1sc(C(N1CCCCC1)=O)c2)N1CCOCC1

InChI

InChI=1S/C19H26N2O3S/c22-18(21-8-10-24-11-9-21)14-4-5-16-15(12-14)13-17(25-16)19(23)20-6-2-1-3-7-20/h13-14H,1-12H2/t14-/m1/s1

InChI Key

MRHSQWPRTSNJRL-CQSZACIVSA-N

MDL Number (MFCD)

MFCD27620296

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.402

Distribution Coefficient, logD

2.402

Water Solubility, LogSw

-2.54

Polar Surface Area

42.383

Acid Dissociation Constant (pKa)

21.06

Base Dissociation Constant (pKb)

-0.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.40

T408-1823 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T408-1823 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T408-1823?
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What is the minimum amount of T408-1823 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T408-1823
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T408-1823
  • 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 T408-1823 available by request