D335-1127 Screening compound: N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylacetamide

D335-1127 Screening compound: N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylacetamide
D335-1127 Screening compound: N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D335-1127
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylacetamide

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

D335-1127

Molecular Formula

C13H14N2OS (C13 H14 N2 OS)

Compound Name

N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylacetamide

IUPAC name

N-[(2-methyl-13-thiazol-4-yl)methyl]-2-phenylacetamide

SMILES

Cc1nc(CNC(Cc2ccccc2)=O)cs1

InChI

InChI=1S/C13H14N2OS/c1-10-15-12(9-17-10)8-14-13(16)7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,14,16)

InChI Key

OIYKDCKASLIGRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12920731

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.254

Distribution Coefficient, logD

2.254

Water Solubility, LogSw

-2.56

Polar Surface Area

34.746

Acid Dissociation Constant (pKa)

13.93

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

D335-1127 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D335-1127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D335-1127?
Check Price and Availability of D335-1127, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D335-1127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D335-1127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D335-1127
  • 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 D335-1127 available by request