F082-0863 Screening compound: 3-(5-bromothiophen-2-yl)-5-methyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-carboxamide

F082-0863 Screening compound: 3-(5-bromothiophen-2-yl)-5-methyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-carboxamide
F082-0863 Screening compound: 3-(5-bromothiophen-2-yl)-5-methyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F082-0863
3-(5-bromothiophen-2-yl)-5-methyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-carboxamide

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

F082-0863

Molecular Formula

C17H15BrN2O2S (C17 H15 BrN2 O2 S)

Compound Name

3-(5-bromothiophen-2-yl)-5-methyl-N-[(4-methylphenyl)methyl]-1,2-oxazole-4-carboxamide

IUPAC name

3-(5-bromothiophen-2-yl)-5-methyl-N-[(4-methylphenyl)methyl]-12-oxazole-4-carboxamide

SMILES

Cc1c(C(NCc2ccc(C)cc2)=O)c(-c(s2)ccc2Br)no1

InChI

InChI=1S/C17H15BrN2O2S/c1-10-3-5-12(6-4-10)9-19-17(21)15-11(2)22-20-16(15)13-7-8-14(18)23-13/h3-8H,9H2,1-2H3,(H,19,21)

InChI Key

NXYCNZFHNRUNJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27100241

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.182

Distribution Coefficient, logD

4.182

Water Solubility, LogSw

-4.37

Polar Surface Area

47.630

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

-3.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with F082-0863 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F082-0863?
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What is the minimum amount of F082-0863 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F082-0863
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F082-0863
  • 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 F082-0863 available by request