Y200-4746 Screening compound: N-(1-benzyl-1H-pyrazol-4-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

Y200-4746 Screening compound: N-(1-benzyl-1H-pyrazol-4-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Y200-4746 Screening compound: N-(1-benzyl-1H-pyrazol-4-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-4746
N-(1-benzyl-1H-pyrazol-4-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

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

Y200-4746

Molecular Formula

C21H16ClFN4O2 (C21 H16 ClFN4 O2)

Compound Name

N-(1-benzyl-1H-pyrazol-4-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

IUPAC name

N-(1-benzyl-1H-pyrazol-4-yl)-3-(2-chloro-6-fluorophenyl)-5-methyl-12-oxazole-4-carboxamide

SMILES

Cc1c(C(Nc2cn(Cc3ccccc3)nc2)=O)c(-c(c(F)ccc2)c2Cl)no1

InChI

InChI=1S/C21H16ClFN4O2/c1-13-18(20(26-29-13)19-16(22)8-5-9-17(19)23)21(28)25-15-10-24-27(12-15)11-14-6-3-2-4-7-14/h2-10,12H,11H2,1H3,(H,25,28)

InChI Key

BVTOSNOPRDXJSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03071516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.527

Distribution Coefficient, logD

3.463

Water Solubility, LogSw

-4.28

Polar Surface Area

59.795

Acid Dissociation Constant (pKa)

8.20

Base Dissociation Constant (pKb)

-2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

Y200-4746 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with Y200-4746 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-4746?
Check Price and Availability of Y200-4746, 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 Y200-4746 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-4746
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-4746
  • 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 Y200-4746 available by request