D354-0098 Screening compound: 5-(3-fluoro-4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}-1,2-oxazole-3-carboxamide

D354-0098 Screening compound: 5-(3-fluoro-4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}-1,2-oxazole-3-carboxamide
D354-0098 Screening compound: 5-(3-fluoro-4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D354-0098
5-(3-fluoro-4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}-1,2-oxazole-3-carboxamide

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

D354-0098

Molecular Formula

C20H15FN4O4S2 (C20 H15 FN4 O4 S2)

Compound Name

5-(3-fluoro-4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}-1,2-oxazole-3-carboxamide

IUPAC name

5-(3-fluoro-4-methylphenyl)-N-{4-[(13-thiazol-2-yl)sulfamoyl]phenyl}-12-oxazole-3-carboxamide

SMILES

Cc(ccc(-c1cc(C(Nc(cc2)ccc2S(Nc2nccs2)(=O)=O)=O)no1)c1)c1F

InChI

InChI=1S/C20H15FN4O4S2/c1-12-2-3-13(10-16(12)21)18-11-17(24-29-18)19(26)23-14-4-6-15(7-5-14)31(27,28)25-20-22-8-9-30-20/h2-11H,1H3,(H,22,25)(H,23,26)

InChI Key

VFBGDNQLEZLYMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08544851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.096

Distribution Coefficient, logD

3.686

Water Solubility, LogSw

-4.25

Polar Surface Area

95.993

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

D354-0098 in Drug Discovery

Included in Screening Libraries

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

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D354-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D354-0098?
Check Price and Availability of D354-0098, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D354-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D354-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D354-0098
  • 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 D354-0098 available by request