M090-0058 Screening compound: N-(3-fluorophenyl)-2,5-dimethyl-4-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-3-sulfonamide

M090-0058 Screening compound: N-(3-fluorophenyl)-2,5-dimethyl-4-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-3-sulfonamide
M090-0058 Screening compound: N-(3-fluorophenyl)-2,5-dimethyl-4-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M090-0058
N-(3-fluorophenyl)-2,5-dimethyl-4-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-3-sulfonamide

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

M090-0058

Molecular Formula

C16H12F4N2O3S2 (C16 H12 F4 N2 O3 S2)

Compound Name

N-(3-fluorophenyl)-2,5-dimethyl-4-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-3-sulfonamide

IUPAC name

N-(3-fluorophenyl)-25-dimethyl-4-[5-(trifluoromethyl)-12-oxazol-3-yl]thiophene-3-sulfonamide

SMILES

Cc1c(-c2noc(C(F)(F)F)c2)c(S(Nc2cc(F)ccc2)(=O)=O)c(C)s1

InChI

InChI=1S/C16H12F4N2O3S2/c1-8-14(12-7-13(25-21-12)16(18,19)20)15(9(2)26-8)27(23,24)22-11-5-3-4-10(17)6-11/h3-7,22H,1-2H3

InChI Key

SBBLKIDJHUXIMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27496604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.844

Distribution Coefficient, logD

4.164

Water Solubility, LogSw

-4.79

Polar Surface Area

63.442

Acid Dissociation Constant (pKa)

6.82

Base Dissociation Constant (pKb)

-4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

M090-0058 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M090-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M090-0058?
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What is the minimum amount of M090-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M090-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M090-0058
  • 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 M090-0058 available by request