P074-3985 Screening compound: 2,5-difluoro-N-{phenyl[5-(piperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl}benzamide

P074-3985 Screening compound: 2,5-difluoro-N-{phenyl[5-(piperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl}benzamide
P074-3985 Screening compound: 2,5-difluoro-N-{phenyl[5-(piperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P074-3985
2,5-difluoro-N-{phenyl[5-(piperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl}benzamide

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

P074-3985

Molecular Formula

C21H20F2N4O2 (C21 H20 F2 N4 O2)

Compound Name

2,5-difluoro-N-{phenyl[5-(piperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl}benzamide

IUPAC name

n/a

SMILES

O=C(c(cc(cc1)F)c1F)NC(c1nnc(N2CCCCC2)o1)c1ccccc1

InChI

InChI=1S/C21H20F2N4O2/c22-15-9-10-17(23)16(13-15)19(28)24-18(14-7-3-1-4-8-14)20-25-26-21(29-20)27-11-5-2-6-12-27/h1,3-4,7-10,13,18H,2,5-6,11-12H2,(H,24,28)/t18-/m1/s1

InChI Key

NVDDOYJWIKEJIH-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27562786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.917

Distribution Coefficient, logD

3.895

Water Solubility, LogSw

-3.95

Polar Surface Area

58.043

Acid Dissociation Constant (pKa)

8.69

Base Dissociation Constant (pKb)

8.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

P074-3985 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with P074-3985 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P074-3985?
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What is the minimum amount of P074-3985 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P074-3985
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P074-3985
  • 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 P074-3985 available by request