P053-3134 Screening compound: N2-cyclopropyl-N4-[(3,5-difluorophenyl)methyl]-1,3-thiazole-2,4-dicarboxamide

P053-3134 Screening compound: N2-cyclopropyl-N4-[(3,5-difluorophenyl)methyl]-1,3-thiazole-2,4-dicarboxamide
P053-3134 Screening compound: N2-cyclopropyl-N4-[(3,5-difluorophenyl)methyl]-1,3-thiazole-2,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P053-3134
N2-cyclopropyl-N4-[(3,5-difluorophenyl)methyl]-1,3-thiazole-2,4-dicarboxamide

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

P053-3134

Molecular Formula

C15H13F2N3O2S (C15 H13 F2 N3 O2 S)

Compound Name

N2-cyclopropyl-N4-[(3,5-difluorophenyl)methyl]-1,3-thiazole-2,4-dicarboxamide

IUPAC name

N2-cyclopropyl-N4-[(35-difluorophenyl)methyl]-13-thiazole-24-dicarboxamide

SMILES

O=C(c1csc(C(NC2CC2)=O)n1)NCc1cc(F)cc(F)c1

InChI

InChI=1S/C15H13F2N3O2S/c16-9-3-8(4-10(17)5-9)6-18-13(21)12-7-23-15(20-12)14(22)19-11-1-2-11/h3-5,7,11H,1-2,6H2,(H,18,21)(H,19,22)

InChI Key

HWKFLRYQRCBDEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27561138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.678

Distribution Coefficient, logD

2.678

Water Solubility, LogSw

-2.98

Polar Surface Area

59.127

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

P053-3134 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P053-3134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P053-3134?
Check Price and Availability of P053-3134, 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 P053-3134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P053-3134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P053-3134
  • 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 P053-3134 available by request