Y030-6413 Screening compound: 2,3-dihydro-1H-indol-1-yl(5-methyl-3-phenyl-4-isoxazolyl)methanone

Y030-6413 Screening compound: 2,3-dihydro-1H-indol-1-yl(5-methyl-3-phenyl-4-isoxazolyl)methanone
Y030-6413 Screening compound: 2,3-dihydro-1H-indol-1-yl(5-methyl-3-phenyl-4-isoxazolyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6413
2,3-dihydro-1H-indol-1-yl(5-methyl-3-phenyl-4-isoxazolyl)methanone

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

Y030-6413

Molecular Formula

C19H16N2O2 (C19 H16 N2 O2)

Compound Name

2,3-dihydro-1H-indol-1-yl(5-methyl-3-phenyl-4-isoxazolyl)methanone

IUPAC name

1-(5-methyl-3-phenyl-12-oxazole-4-carbonyl)-23-dihydro-1H-indole

SMILES

Cc1c(C(N(CC2)c3c2cccc3)=O)c(-c2ccccc2)no1

InChI

InChI=1S/C19H16N2O2/c1-13-17(18(20-23-13)15-8-3-2-4-9-15)19(22)21-12-11-14-7-5-6-10-16(14)21/h2-10H,11-12H2,1H3

InChI Key

YDLQOELKARWXLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01331332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.343

Distribution Coefficient, logD

3.343

Water Solubility, LogSw

-3.57

Polar Surface Area

37.877

Acid Dissociation Constant (pKa)

25.87

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

Y030-6413 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

Antifungal Library (16415 compounds)

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y030-6413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6413?
Check Price and Availability of Y030-6413, 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 Y030-6413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6413
  • 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 Y030-6413 available by request