C301-6691 Screening compound: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-3-methylbutanamide

C301-6691 Screening compound: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-3-methylbutanamide
C301-6691 Screening compound: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-6691
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-3-methylbutanamide

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

C301-6691

Molecular Formula

C16H19BrN2OS (C16 H19 BrN2 OS)

Compound Name

N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-3-methylbutanamide

IUPAC name

N-[4-(4-bromophenyl)-13-thiazol-2-yl]-N-ethyl-3-methylbutanamide

SMILES

CCN(C(CC(C)C)=O)c1nc(-c(cc2)ccc2Br)cs1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.794

Distribution Coefficient, logD

5.794

Water Solubility, LogSw

-5.48

Polar Surface Area

24.879

Acid Dissociation Constant (pKa)

24.47

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C301-6691 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with C301-6691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-6691?
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What is the minimum amount of C301-6691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-6691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-6691
  • 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 C301-6691 available by request