G939-0994 Screening compound: 1-(4-fluorophenyl)-4-[2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonyl]piperazine

G939-0994 Screening compound: 1-(4-fluorophenyl)-4-[2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonyl]piperazine
G939-0994 Screening compound: 1-(4-fluorophenyl)-4-[2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G939-0994
1-(4-fluorophenyl)-4-[2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonyl]piperazine

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

G939-0994

Molecular Formula

C20H20FN3O4S (C20 H20 FN3 O4 S)

Compound Name

1-(4-fluorophenyl)-4-[2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonyl]piperazine

IUPAC name

1-(4-fluorophenyl)-4-[2-methoxy-4-(12-oxazol-5-yl)benzenesulfonyl]piperazine

SMILES

COc(cc(cc1)-c2ccno2)c1S(N(CC1)CCN1c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C20H20FN3O4S/c1-27-19-14-15(18-8-9-22-28-18)2-7-20(19)29(25,26)24-12-10-23(11-13-24)17-5-3-16(21)4-6-17/h2-9,14H,10-13H2,1H3

InChI Key

SJUPRTRCENPURL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15076349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.917

Distribution Coefficient, logD

2.917

Water Solubility, LogSw

-3.37

Polar Surface Area

64.709

Acid Dissociation Constant (pKa)

27.87

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G939-0994 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G939-0994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G939-0994?
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What is the minimum amount of G939-0994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G939-0994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G939-0994
  • 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 G939-0994 available by request