2543-0003 Screening compound: (4Z)-2-(3-bromophenyl)-4-[(dimethylamino)methylidene]-4,5-dihydro-1,3-oxazol-5-one

2543-0003 Screening compound: (4Z)-2-(3-bromophenyl)-4-[(dimethylamino)methylidene]-4,5-dihydro-1,3-oxazol-5-one
2543-0003 Screening compound: (4Z)-2-(3-bromophenyl)-4-[(dimethylamino)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2543-0003
(4Z)-2-(3-bromophenyl)-4-[(dimethylamino)methylidene]-4,5-dihydro-1,3-oxazol-5-one

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

2543-0003

Molecular Formula

C12H11BrN2O2 (C12 H11 BrN2 O2)

Compound Name

(4Z)-2-(3-bromophenyl)-4-[(dimethylamino)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-2-(3-bromophenyl)-4-[(dimethylamino)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

CN(C)/C=C1\N=C(c2cccc(Br)c2)OC1=O

InChI

InChI=1S/C12H11BrN2O2/c1-15(2)7-10-12(16)17-11(14-10)8-4-3-5-9(13)6-8/h3-7H,1-2H3

InChI Key

CKCIRMLYTXKQML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01947952

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.14

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.767

Distribution Coefficient, logD

1.767

Water Solubility, LogSw

-2.15

Polar Surface Area

35.145

Acid Dissociation Constant (pKa)

34.55

Base Dissociation Constant (pKb)

7.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 2543-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2543-0003?
Check Price and Availability of 2543-0003, 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 2543-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2543-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2543-0003
  • 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 2543-0003 available by request