7100-1128 Screening compound: 1-(4-{[4-(pyridin-3-yl)-1,3-thiazol-2-yl]amino}phenyl)ethan-1-one

7100-1128 Screening compound: 1-(4-{[4-(pyridin-3-yl)-1,3-thiazol-2-yl]amino}phenyl)ethan-1-one
7100-1128 Screening compound: 1-(4-{[4-(pyridin-3-yl)-1,3-thiazol-2-yl]amino}phenyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7100-1128
1-(4-{[4-(pyridin-3-yl)-1,3-thiazol-2-yl]amino}phenyl)ethan-1-one

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

7100-1128

Molecular Formula

C16H13N3OS (C16 H13 N3 OS)

Compound Name

1-(4-{[4-(pyridin-3-yl)-1,3-thiazol-2-yl]amino}phenyl)ethan-1-one

IUPAC name

1-(4-{[4-(pyridin-3-yl)-13-thiazol-2-yl]amino}phenyl)ethan-1-one

SMILES

CC(c(cc1)ccc1Nc1nc(-c2cnccc2)cs1)=O

InChI

InChI=1S/C16H13N3OS/c1-11(20)12-4-6-14(7-5-12)18-16-19-15(10-21-16)13-3-2-8-17-9-13/h2-10H,1H3,(H,18,19)

InChI Key

CLQJYVLSFKXPRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05239996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.349

Distribution Coefficient, logD

3.327

Water Solubility, LogSw

-3.38

Polar Surface Area

42.270

Acid Dissociation Constant (pKa)

18.48

Base Dissociation Constant (pKb)

6.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

7100-1128 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 7100-1128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7100-1128?
Check Price and Availability of 7100-1128, 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 7100-1128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7100-1128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7100-1128
  • 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 7100-1128 available by request