G189-2282 Screening compound: ethyl 5-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate

G189-2282 Screening compound: ethyl 5-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate
G189-2282 Screening compound: ethyl 5-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G189-2282
ethyl 5-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-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

G189-2282

Molecular Formula

C22H24N2O7S (C22 H24 N2 O7 S)

Compound Name

ethyl 5-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate

IUPAC name

ethyl 5-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]-4-methoxyphenyl}-12-oxazole-3-carboxylate

SMILES

CCOC(c1noc(-c(cc2)cc(S(N(C)c(cc3)ccc3OCC)(=O)=O)c2OC)c1)=O

InChI

InChI=1S/C22H24N2O7S/c1-5-29-17-10-8-16(9-11-17)24(3)32(26,27)21-13-15(7-12-19(21)28-4)20-14-18(23-31-20)22(25)30-6-2/h7-14H,5-6H2,1-4H3

InChI Key

JFKNQQCEFUBVOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14983022

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.305

Distribution Coefficient, logD

4.305

Water Solubility, LogSw

-4.32

Polar Surface Area

90.103

Acid Dissociation Constant (pKa)

29.13

Base Dissociation Constant (pKb)

-7.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G189-2282 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G189-2282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G189-2282?
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What is the minimum amount of G189-2282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G189-2282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G189-2282
  • 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 G189-2282 available by request