8005-7640 Screening compound: (4Z)-2-(4-tert-butylphenyl)-4-[(2,6-dichlorophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

8005-7640 Screening compound: (4Z)-2-(4-tert-butylphenyl)-4-[(2,6-dichlorophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
8005-7640 Screening compound: (4Z)-2-(4-tert-butylphenyl)-4-[(2,6-dichlorophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-7640
(4Z)-2-(4-tert-butylphenyl)-4-[(2,6-dichlorophenyl)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

8005-7640

Molecular Formula

C20H17Cl2NO2 (C20 H17 Cl2 NO2)

Compound Name

(4Z)-2-(4-tert-butylphenyl)-4-[(2,6-dichlorophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-2-(4-tert-butylphenyl)-4-[(26-dichlorophenyl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

CC(C)(C)c(cc1)ccc1C(OC1=O)=N/C1=C\c(c(Cl)ccc1)c1Cl

InChI

InChI=1S/C20H17Cl2NO2/c1-20(2,3)13-9-7-12(8-10-13)18-23-17(19(24)25-18)11-14-15(21)5-4-6-16(14)22/h4-11H,1-3H3

InChI Key

YZBJNVICNFGNCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00822169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.569

Distribution Coefficient, logD

5.569

Water Solubility, LogSw

-5.97

Polar Surface Area

30.376

Acid Dissociation Constant (pKa)

30.17

Base Dissociation Constant (pKb)

-0.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8005-7640 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8005-7640 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-7640?
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What is the minimum amount of 8005-7640 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-7640
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-7640
  • 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 8005-7640 available by request