G790-0331 Screening compound: methyl 5-[(4-chlorophenyl)amino]-3-(4-fluorophenyl)-1,2-oxazole-4-carboxylate

G790-0331 Screening compound: methyl 5-[(4-chlorophenyl)amino]-3-(4-fluorophenyl)-1,2-oxazole-4-carboxylate
G790-0331 Screening compound: methyl 5-[(4-chlorophenyl)amino]-3-(4-fluorophenyl)-1,2-oxazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G790-0331
methyl 5-[(4-chlorophenyl)amino]-3-(4-fluorophenyl)-1,2-oxazole-4-carboxylate

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

G790-0331

Molecular Formula

C17H12ClFN2O3 (C17 H12 ClFN2 O3)

Compound Name

methyl 5-[(4-chlorophenyl)amino]-3-(4-fluorophenyl)-1,2-oxazole-4-carboxylate

IUPAC name

methyl 5-[(4-chlorophenyl)amino]-3-(4-fluorophenyl)-12-oxazole-4-carboxylate

SMILES

COC(c1c(Nc(cc2)ccc2Cl)onc1-c(cc1)ccc1F)=O

InChI

InChI=1S/C17H12ClFN2O3/c1-23-17(22)14-15(10-2-6-12(19)7-3-10)21-24-16(14)20-13-8-4-11(18)5-9-13/h2-9,20H,1H3

InChI Key

CMUBVBKWJQZIIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27158181

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.322

Distribution Coefficient, logD

4.322

Water Solubility, LogSw

-5.03

Polar Surface Area

52.911

Acid Dissociation Constant (pKa)

14.17

Base Dissociation Constant (pKb)

-8.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

G790-0331 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G790-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G790-0331?
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What is the minimum amount of G790-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G790-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G790-0331
  • 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 G790-0331 available by request