M331-0407 Screening compound: N-{5-[(1E)-2-{5-[(3-chloro-2-methylphenyl)sulfamoyl]thiophen-2-yl}ethenyl]-3-methyl-1,2-oxazol-4-yl}propanamide

M331-0407 Screening compound: N-{5-[(1E)-2-{5-[(3-chloro-2-methylphenyl)sulfamoyl]thiophen-2-yl}ethenyl]-3-methyl-1,2-oxazol-4-yl}propanamide
M331-0407 Screening compound: N-{5-[(1E)-2-{5-[(3-chloro-2-methylphenyl)sulfamoyl]thiophen-2-yl}ethenyl]-3-methyl-1,2-oxazol-4-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M331-0407
N-{5-[(1E)-2-{5-[(3-chloro-2-methylphenyl)sulfamoyl]thiophen-2-yl}ethenyl]-3-methyl-1,2-oxazol-4-yl}propanamide

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

M331-0407

Molecular Formula

C20H20ClN3O4S2 (C20 H20 ClN3 O4 S2)

Compound Name

N-{5-[(1E)-2-{5-[(3-chloro-2-methylphenyl)sulfamoyl]thiophen-2-yl}ethenyl]-3-methyl-1,2-oxazol-4-yl}propanamide

IUPAC name

N-{5-[(1E)-2-{5-[(3-chloro-2-methylphenyl)sulfamoyl]thiophen-2-yl}ethenyl]-3-methyl-12-oxazol-4-yl}propanamide

SMILES

CCC(Nc1c(/C=C/c(s2)ccc2S(Nc2cccc(Cl)c2C)(=O)=O)onc1C)=O

InChI

InChI=1S/C20H20ClN3O4S2/c1-4-18(25)22-20-13(3)23-28-17(20)10-8-14-9-11-19(29-14)30(26,27)24-16-7-5-6-15(21)12(16)2/h5-11,24H,4H2,1-3H3,(H,22,25)

InChI Key

JQYAXVLWYFMKOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27536514

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.206

Distribution Coefficient, logD

3.951

Water Solubility, LogSw

-4.26

Polar Surface Area

84.478

Acid Dissociation Constant (pKa)

7.50

Base Dissociation Constant (pKb)

-5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with M331-0407 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M331-0407?
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What is the minimum amount of M331-0407 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M331-0407
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M331-0407
  • 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 M331-0407 available by request