P708-0538 Screening compound: 1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-N-[(2-fluorophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide

P708-0538 Screening compound: 1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-N-[(2-fluorophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide
P708-0538 Screening compound: 1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-N-[(2-fluorophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P708-0538
1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-N-[(2-fluorophenyl)methyl]-5-methyl-1H-pyrazole-4-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

P708-0538

Molecular Formula

C21H19FN6O2 (C21 H19 FN6 O2)

Compound Name

1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-N-[(2-fluorophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide

IUPAC name

1-[4-(3-ethyl-124-oxadiazol-5-yl)pyridin-2-yl]-N-[(2-fluorophenyl)methyl]-5-methyl-1H-pyrazole-4-carboxamide

SMILES

CCc1noc(-c2cc(-n3ncc(C(NCc(cccc4)c4F)=O)c3C)ncc2)n1

InChI

InChI=1S/C21H19FN6O2/c1-3-18-26-21(30-27-18)14-8-9-23-19(10-14)28-13(2)16(12-25-28)20(29)24-11-15-6-4-5-7-17(15)22/h4-10,12H,3,11H2,1-2H3,(H,24,29)

InChI Key

NLYLWMGBRYGYKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.071

Distribution Coefficient, logD

4.071

Water Solubility, LogSw

-3.97

Polar Surface Area

79.896

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

P708-0538 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system

References: we are preparing a list of scientific research reports with P708-0538 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P708-0538?
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What is the minimum amount of P708-0538 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P708-0538
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P708-0538
  • 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 P708-0538 available by request