M358-0093 Screening compound: 4-{[4-(dimethylsulfamoyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-[(4-fluorophenyl)methyl]benzamide

M358-0093 Screening compound: 4-{[4-(dimethylsulfamoyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-[(4-fluorophenyl)methyl]benzamide
M358-0093 Screening compound: 4-{[4-(dimethylsulfamoyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-[(4-fluorophenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M358-0093
4-{[4-(dimethylsulfamoyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-[(4-fluorophenyl)methyl]benzamide

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

M358-0093

Molecular Formula

C22H25FN4O3S (C22 H25 FN4 O3 S)

Compound Name

4-{[4-(dimethylsulfamoyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-[(4-fluorophenyl)methyl]benzamide

IUPAC name

4-{[4-(dimethylsulfamoyl)-35-dimethyl-1H-pyrazol-1-yl]methyl}-N-[(4-fluorophenyl)methyl]benzamide

SMILES

Cc(n(Cc(cc1)ccc1C(NCc(cc1)ccc1F)=O)nc1C)c1S(N(C)C)(=O)=O

InChI

InChI=1S/C22H25FN4O3S/c1-15-21(31(29,30)26(3)4)16(2)27(25-15)14-18-5-9-19(10-6-18)22(28)24-13-17-7-11-20(23)12-8-17/h5-12H,13-14H2,1-4H3,(H,24,28)

InChI Key

IFJNIXUNYINIJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27538625

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.851

Distribution Coefficient, logD

1.851

Water Solubility, LogSw

-2.54

Polar Surface Area

72.597

Acid Dissociation Constant (pKa)

11.18

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

M358-0093 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 M358-0093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M358-0093?
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What is the minimum amount of M358-0093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M358-0093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M358-0093
  • 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 M358-0093 available by request