2113-0063 Screening compound: (4Z)-2-(4-chlorophenyl)-4-{[(2-iodophenyl)amino]methylidene}-4,5-dihydro-1,3-oxazol-5-one

2113-0063 Screening compound: (4Z)-2-(4-chlorophenyl)-4-{[(2-iodophenyl)amino]methylidene}-4,5-dihydro-1,3-oxazol-5-one
2113-0063 Screening compound: (4Z)-2-(4-chlorophenyl)-4-{[(2-iodophenyl)amino]methylidene}-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2113-0063
(4Z)-2-(4-chlorophenyl)-4-{[(2-iodophenyl)amino]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

2113-0063

Molecular Formula

C16H10ClIN2O2 (C16 H10 ClIN2 O2)

Compound Name

(4Z)-2-(4-chlorophenyl)-4-{[(2-iodophenyl)amino]methylidene}-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-2-(4-chlorophenyl)-4-{[(2-iodophenyl)amino]methylidene}-45-dihydro-13-oxazol-5-one

SMILES

O=C1OC(c(cc2)ccc2Cl)=N/C1=C\Nc(cccc1)c1I

InChI

InChI=1S/C16H10ClIN2O2/c17-11-7-5-10(6-8-11)15-20-14(16(21)22-15)9-19-13-4-2-1-3-12(13)18/h1-9,19H

InChI Key

SWNYCJTXXBTDBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01247791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.62

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.189

Distribution Coefficient, logD

4.187

Water Solubility, LogSw

-4.77

Polar Surface Area

41.279

Acid Dissociation Constant (pKa)

9.84

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 2113-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2113-0063?
Check Price and Availability of 2113-0063, 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 2113-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2113-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2113-0063
  • 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 2113-0063 available by request