P059-0283 Screening compound: 5-chloro-N-{[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]methyl}thiophene-2-carboxamide

P059-0283 Screening compound: 5-chloro-N-{[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]methyl}thiophene-2-carboxamide
P059-0283 Screening compound: 5-chloro-N-{[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]methyl}thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P059-0283
5-chloro-N-{[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]methyl}thiophene-2-carboxamide

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

P059-0283

Molecular Formula

C17H16ClN3OS (C17 H16 ClN3 OS)

Compound Name

5-chloro-N-{[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]methyl}thiophene-2-carboxamide

IUPAC name

5-chloro-N-{[4-(35-dimethyl-1H-pyrazol-1-yl)phenyl]methyl}thiophene-2-carboxamide

SMILES

Cc1cc(C)nn1-c1ccc(CNC(c(s2)ccc2Cl)=O)cc1

InChI

InChI=1S/C17H16ClN3OS/c1-11-9-12(2)21(20-11)14-5-3-13(4-6-14)10-19-17(22)15-7-8-16(18)23-15/h3-9H,10H2,1-2H3,(H,19,22)

InChI Key

NFRVFRSQUIIKKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27561619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.85

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.267

Distribution Coefficient, logD

3.267

Water Solubility, LogSw

-3.64

Polar Surface Area

39.542

Acid Dissociation Constant (pKa)

11.19

Base Dissociation Constant (pKb)

3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

P059-0283 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with P059-0283 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P059-0283?
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What is the minimum amount of P059-0283 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P059-0283
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P059-0283
  • 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 P059-0283 available by request