M089-0068 Screening compound: 2-methyl-N-[(4-methylphenyl)methyl]-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonamide

M089-0068 Screening compound: 2-methyl-N-[(4-methylphenyl)methyl]-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonamide
M089-0068 Screening compound: 2-methyl-N-[(4-methylphenyl)methyl]-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M089-0068
2-methyl-N-[(4-methylphenyl)methyl]-5-[5-(trifluoromethyl)-1H-pyrazol-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

M089-0068

Molecular Formula

C17H16F3N3O2S2 (C17 H16 F3 N3 O2 S2)

Compound Name

2-methyl-N-[(4-methylphenyl)methyl]-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonamide

IUPAC name

2-methyl-N-[(4-methylphenyl)methyl]-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonamide

SMILES

Cc(sc(-c1n[nH]c(C(F)(F)F)c1)c1)c1S(NCc1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C17H16F3N3O2S2/c1-10-3-5-12(6-4-10)9-21-27(24,25)15-8-14(26-11(15)2)13-7-16(23-22-13)17(18,19)20/h3-8,21H,9H2,1-2H3,(H,22,23)

InChI Key

LHSSMRHWNHDEEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15140756

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.765

Distribution Coefficient, logD

4.758

Water Solubility, LogSw

-4.53

Polar Surface Area

65.505

Acid Dissociation Constant (pKa)

5.70

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with M089-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M089-0068?
Check Price and Availability of M089-0068, 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 M089-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M089-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M089-0068
  • 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 M089-0068 available by request