M022-1085 Screening compound: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}thiophene-2-sulfonamide

M022-1085 Screening compound: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}thiophene-2-sulfonamide
M022-1085 Screening compound: 4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}thiophene-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M022-1085
4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}thiophene-2-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

M022-1085

Molecular Formula

C17H15F3N2O2S3 (C17 H15 F3 N2 O2 S3)

Compound Name

4-(4,5-dimethyl-1,3-thiazol-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}thiophene-2-sulfonamide

IUPAC name

4-(45-dimethyl-13-thiazol-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}thiophene-2-sulfonamide

SMILES

Cc1c(C)sc(-c2csc(S(NCc3cc(C(F)(F)F)ccc3)(=O)=O)c2)n1

InChI

InChI=1S/C17H15F3N2O2S3/c1-10-11(2)26-16(22-10)13-7-15(25-9-13)27(23,24)21-8-12-4-3-5-14(6-12)17(18,19)20/h3-7,9,21H,8H2,1-2H3

InChI Key

AGQCVDKPFQBBLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27493011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.849

Distribution Coefficient, logD

4.846

Water Solubility, LogSw

-4.73

Polar Surface Area

53.326

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

M022-1085 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with M022-1085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M022-1085?
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What is the minimum amount of M022-1085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M022-1085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M022-1085
  • 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 M022-1085 available by request