F082-0817 Screening compound: 3-(5-bromothiophen-2-yl)-N-[(3-chlorophenyl)methyl]-5-methyl-1,2-oxazole-4-carboxamide

F082-0817 Screening compound: 3-(5-bromothiophen-2-yl)-N-[(3-chlorophenyl)methyl]-5-methyl-1,2-oxazole-4-carboxamide
F082-0817 Screening compound: 3-(5-bromothiophen-2-yl)-N-[(3-chlorophenyl)methyl]-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F082-0817
3-(5-bromothiophen-2-yl)-N-[(3-chlorophenyl)methyl]-5-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

F082-0817

Molecular Formula

C16H12BrClN2O2S (C16 H12 BrClN2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(C(NCc2cc(Cl)ccc2)=O)c(-c(s2)ccc2Br)no1

InChI

InChI=1S/C16H12BrClN2O2S/c1-9-14(15(20-22-9)12-5-6-13(17)23-12)16(21)19-8-10-3-2-4-11(18)7-10/h2-7H,8H2,1H3,(H,19,21)

InChI Key

DNAFVSOFGOXVRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27100211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.71

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

4.456

Distribution Coefficient, logD

4.456

Water Solubility, LogSw

-4.78

Polar Surface Area

47.630

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with F082-0817 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F082-0817?
Check Price and Availability of F082-0817, 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 F082-0817 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F082-0817
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F082-0817
  • 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 F082-0817 available by request