2159-1411 Screening compound: 3-(2-CHLOROPHENYL)-N-(2-ISOPROPYLPHENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDE

2159-1411 Screening compound: 3-(2-CHLOROPHENYL)-N-(2-ISOPROPYLPHENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDE
2159-1411 Screening compound: 3-(2-CHLOROPHENYL)-N-(2-ISOPROPYLPHENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 2159-1411
3-(2-CHLOROPHENYL)-N-(2-ISOPROPYLPHENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDE

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

2159-1411

Molecular Formula

C20H19ClN2O2 (C20 H19 ClN2 O2)

Compound Name

3-(2-CHLOROPHENYL)-N-(2-ISOPROPYLPHENYL)-5-METHYL-4-ISOXAZOLECARBOXAMIDE

IUPAC name

n/a

SMILES

CC(C)c(cccc1)c1NC(c1c(C)onc1-c(cccc1)c1Cl)=O

InChI

InChI=1S/C20H19ClN2O2/c1-12(2)14-8-5-7-11-17(14)22-20(24)18-13(3)25-23-19(18)15-9-4-6-10-16(15)21/h4-12H,1-3H3,(H,22,24)

InChI Key

GZVALEJZLAHRPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01182896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.658

Distribution Coefficient, logD

4.658

Water Solubility, LogSw

-4.97

Polar Surface Area

44.592

Acid Dissociation Constant (pKa)

11.72

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

2159-1411 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Serine Proteases Inhibitors Library (32732 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
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 2159-1411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2159-1411?
Check Price and Availability of 2159-1411, 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 2159-1411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2159-1411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2159-1411
  • 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 2159-1411 available by request