1967-9217 Screening compound: (4Z)-2-(5-bromofuran-2-yl)-4-{[4-(dimethylamino)phenyl]methylidene}-4,5-dihydro-1,3-oxazol-5-one

1967-9217 Screening compound: (4Z)-2-(5-bromofuran-2-yl)-4-{[4-(dimethylamino)phenyl]methylidene}-4,5-dihydro-1,3-oxazol-5-one
1967-9217 Screening compound: (4Z)-2-(5-bromofuran-2-yl)-4-{[4-(dimethylamino)phenyl]methylidene}-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1967-9217
(4Z)-2-(5-bromofuran-2-yl)-4-{[4-(dimethylamino)phenyl]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

1967-9217

Molecular Formula

C16H13BrN2O3 (C16 H13 BrN2 O3)

Compound Name

(4Z)-2-(5-bromofuran-2-yl)-4-{[4-(dimethylamino)phenyl]methylidene}-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-2-(5-bromofuran-2-yl)-4-{[4-(dimethylamino)phenyl]methylidene}-45-dihydro-13-oxazol-5-one

SMILES

CN(C)c1ccc(/C=C2\N=C(c(o3)ccc3Br)OC2=O)cc1

InChI

InChI=1S/C16H13BrN2O3/c1-19(2)11-5-3-10(4-6-11)9-12-16(20)22-15(18-12)13-7-8-14(17)21-13/h3-9H,1-2H3

InChI Key

RDOZSTCYUAKHAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00619733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.19

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.339

Distribution Coefficient, logD

3.339

Water Solubility, LogSw

-3.74

Polar Surface Area

42.106

Acid Dissociation Constant (pKa)

30.86

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 1967-9217 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1967-9217?
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What is the minimum amount of 1967-9217 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1967-9217
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1967-9217
  • 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 1967-9217 available by request