G783-0178 Screening compound: (2E)-1-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl}-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

G783-0178 Screening compound: (2E)-1-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl}-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
G783-0178 Screening compound: (2E)-1-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl}-3-(3,4-dimethoxyphenyl)prop-2-en-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G783-0178
(2E)-1-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl}-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

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

G783-0178

Molecular Formula

C23H23ClN4O4 (C23 H23 ClN4 O4)

Compound Name

(2E)-1-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl}-3-(3,4-dimethoxyphenyl)prop-2-en-1-one

IUPAC name

(2E)-1-{4-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]piperazin-1-yl}-3-(34-dimethoxyphenyl)prop-2-en-1-one

SMILES

COc(ccc(/C=C/C(N(CC1)CCN1c1nc(-c(cc2)ccc2Cl)no1)=O)c1)c1OC

InChI

InChI=1S/C23H23ClN4O4/c1-30-19-9-3-16(15-20(19)31-2)4-10-21(29)27-11-13-28(14-12-27)23-25-22(26-32-23)17-5-7-18(24)8-6-17/h3-10,15H,11-14H2,1-2H3

InChI Key

XSHRMFCIASPNFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15035770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.279

Distribution Coefficient, logD

4.279

Water Solubility, LogSw

-4.83

Polar Surface Area

66.629

Acid Dissociation Constant (pKa)

23.82

Base Dissociation Constant (pKb)

1.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

G783-0178 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with G783-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G783-0178?
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What is the minimum amount of G783-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G783-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G783-0178
  • 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 G783-0178 available by request