G026-0274 Screening compound: methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate

G026-0274 Screening compound: methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate
G026-0274 Screening compound: methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G026-0274
methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate

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

G026-0274

Molecular Formula

C19H14ClN5O3 (C19 H14 ClN5 O3)

Compound Name

methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate

IUPAC name

methyl 4-{4-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]-5-methyl-1H-123-triazol-1-yl}benzoate

SMILES

Cc1c(-c2nc(-c(cc3)ccc3Cl)no2)nnn1-c(cc1)ccc1C(OC)=O

InChI

InChI=1S/C19H14ClN5O3/c1-11-16(18-21-17(23-28-18)12-3-7-14(20)8-4-12)22-24-25(11)15-9-5-13(6-10-15)19(26)27-2/h3-10H,1-2H3

InChI Key

QPYKDLFUHCPXSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08141433

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.8

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.442

Distribution Coefficient, logD

4.442

Water Solubility, LogSw

-4.66

Polar Surface Area

79.661

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

-1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

G026-0274 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G026-0274 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G026-0274?
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What is the minimum amount of G026-0274 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G026-0274
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G026-0274
  • 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 G026-0274 available by request