M331-0494 Screening compound: N-{3-methyl-5-[(1E)-2-(5-{[(5-methylfuran-2-yl)methyl]sulfamoyl}thiophen-2-yl)ethenyl]-1,2-oxazol-4-yl}propanamide

M331-0494 Screening compound: N-{3-methyl-5-[(1E)-2-(5-{[(5-methylfuran-2-yl)methyl]sulfamoyl}thiophen-2-yl)ethenyl]-1,2-oxazol-4-yl}propanamide
M331-0494 Screening compound: N-{3-methyl-5-[(1E)-2-(5-{[(5-methylfuran-2-yl)methyl]sulfamoyl}thiophen-2-yl)ethenyl]-1,2-oxazol-4-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M331-0494
N-{3-methyl-5-[(1E)-2-(5-{[(5-methylfuran-2-yl)methyl]sulfamoyl}thiophen-2-yl)ethenyl]-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

M331-0494

Molecular Formula

C19H21N3O5S2 (C19 H21 N3 O5 S2)

Compound Name

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

IUPAC name

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

SMILES

CCC(Nc1c(/C=C/c(s2)ccc2S(NCc2ccc(C)o2)(=O)=O)onc1C)=O

InChI

InChI=1S/C19H21N3O5S2/c1-4-17(23)21-19-13(3)22-27-16(19)9-7-15-8-10-18(28-15)29(24,25)20-11-14-6-5-12(2)26-14/h5-10,20H,4,11H2,1-3H3,(H,21,23)

InChI Key

GNDAQVWEEXMTEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27536552

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.800

Distribution Coefficient, logD

2.799

Water Solubility, LogSw

-3.22

Polar Surface Area

93.547

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

-5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with M331-0494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M331-0494?
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What is the minimum amount of M331-0494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M331-0494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M331-0494
  • 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 M331-0494 available by request