6903-0011 Screening compound: 3-(4-CHLOROBENZYL)-1-(5-METHYL-3-ISOXAZOLYL)DIHYDRO-1H-PYRROLE-2,5-DIONE

6903-0011 Screening compound: 3-(4-CHLOROBENZYL)-1-(5-METHYL-3-ISOXAZOLYL)DIHYDRO-1H-PYRROLE-2,5-DIONE
6903-0011 Screening compound: 3-(4-CHLOROBENZYL)-1-(5-METHYL-3-ISOXAZOLYL)DIHYDRO-1H-PYRROLE-2,5-DIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 6903-0011
3-(4-CHLOROBENZYL)-1-(5-METHYL-3-ISOXAZOLYL)DIHYDRO-1H-PYRROLE-2,5-DIONE

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

6903-0011

Molecular Formula

C15H13ClN2O3 (C15 H13 ClN2 O3)

Compound Name

3-(4-CHLOROBENZYL)-1-(5-METHYL-3-ISOXAZOLYL)DIHYDRO-1H-PYRROLE-2,5-DIONE

IUPAC name

n/a

SMILES

Cc1cc(N(C(CC2Cc(cc3)ccc3Cl)=O)C2=O)no1

InChI

InChI=1S/C15H13ClN2O3/c1-9-6-13(17-21-9)18-14(19)8-11(15(18)20)7-10-2-4-12(16)5-3-10/h2-6,11H,7-8H2,1H3/t11-/m0/s1

InChI Key

YVNZAXIDUWUZAA-NSHDSACASA-N

MDL Number (MFCD)

MFCD05990435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.73

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.905

Distribution Coefficient, logD

2.905

Water Solubility, LogSw

-3.31

Polar Surface Area

49.849

Acid Dissociation Constant (pKa)

17.06

Base Dissociation Constant (pKb)

-7.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.70

6903-0011 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 6903-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6903-0011?
Check Price and Availability of 6903-0011, 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 6903-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6903-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6903-0011
  • 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 6903-0011 available by request