P074-2954 Screening compound: N-{1-[5-(azepan-1-yl)-1,3,4-oxadiazol-2-yl]-2-phenylethyl}-3,4-difluorobenzamide

P074-2954 Screening compound: N-{1-[5-(azepan-1-yl)-1,3,4-oxadiazol-2-yl]-2-phenylethyl}-3,4-difluorobenzamide
P074-2954 Screening compound: N-{1-[5-(azepan-1-yl)-1,3,4-oxadiazol-2-yl]-2-phenylethyl}-3,4-difluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P074-2954
N-{1-[5-(azepan-1-yl)-1,3,4-oxadiazol-2-yl]-2-phenylethyl}-3,4-difluorobenzamide

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

P074-2954

Molecular Formula

C23H24F2N4O2 (C23 H24 F2 N4 O2)

Compound Name

N-{1-[5-(azepan-1-yl)-1,3,4-oxadiazol-2-yl]-2-phenylethyl}-3,4-difluorobenzamide

IUPAC name

N-{1-[5-(azepan-1-yl)-134-oxadiazol-2-yl]-2-phenylethyl}-34-difluorobenzamide

SMILES

O=C(c(cc1)cc(F)c1F)NC(Cc1ccccc1)c1nnc(N2CCCCCC2)o1

InChI

InChI=1S/C23H24F2N4O2/c24-18-11-10-17(15-19(18)25)21(30)26-20(14-16-8-4-3-5-9-16)22-27-28-23(31-22)29-12-6-1-2-7-13-29/h3-5,8-11,15,20H,1-2,6-7,12-14H2,(H,26,30)/t20-/m0/s1

InChI Key

SDUVZZPQRMRIIR-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27562664

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.357

Distribution Coefficient, logD

4.356

Water Solubility, LogSw

-4.33

Polar Surface Area

58.653

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

8.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

P074-2954 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 P074-2954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P074-2954?
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What is the minimum amount of P074-2954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P074-2954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P074-2954
  • 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 P074-2954 available by request