G790-0127 Screening compound: methyl 3-(4-chlorophenyl)-5-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-1,2-oxazole-4-carboxylate

G790-0127 Screening compound: methyl 3-(4-chlorophenyl)-5-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-1,2-oxazole-4-carboxylate
G790-0127 Screening compound: methyl 3-(4-chlorophenyl)-5-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-1,2-oxazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G790-0127
methyl 3-(4-chlorophenyl)-5-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-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

G790-0127

Molecular Formula

C25H28ClN3O3 (C25 H28 ClN3 O3)

Compound Name

methyl 3-(4-chlorophenyl)-5-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-1,2-oxazole-4-carboxylate

IUPAC name

methyl 3-(4-chlorophenyl)-5-[({1-[(4-methylphenyl)methyl]piperidin-4-yl}methyl)amino]-12-oxazole-4-carboxylate

SMILES

Cc1ccc(CN2CCC(CNc3c(C(OC)=O)c(-c(cc4)ccc4Cl)no3)CC2)cc1

InChI

InChI=1S/C25H28ClN3O3/c1-17-3-5-19(6-4-17)16-29-13-11-18(12-14-29)15-27-24-22(25(30)31-2)23(28-32-24)20-7-9-21(26)10-8-20/h3-10,18,27H,11-16H2,1-2H3

InChI Key

HOBWAIXRPDFGHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15036215

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.97

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.109

Distribution Coefficient, logD

2.429

Water Solubility, LogSw

-5.81

Polar Surface Area

57.966

Acid Dissociation Constant (pKa)

15.89

Base Dissociation Constant (pKb)

10.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

G790-0127 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • Phosphatases

References: we are preparing a list of scientific research reports with G790-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G790-0127?
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What is the minimum amount of G790-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G790-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G790-0127
  • 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 G790-0127 available by request