K213-0063 Screening compound: N-(2-benzamido-5-ethoxyphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

K213-0063 Screening compound: N-(2-benzamido-5-ethoxyphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
K213-0063 Screening compound: N-(2-benzamido-5-ethoxyphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K213-0063
N-(2-benzamido-5-ethoxyphenyl)-3-(2-chlorophenyl)-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

K213-0063

Molecular Formula

C26H22ClN3O4 (C26 H22 ClN3 O4)

Compound Name

N-(2-benzamido-5-ethoxyphenyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

IUPAC name

N-(2-benzamido-5-ethoxyphenyl)-3-(2-chlorophenyl)-5-methyl-12-oxazole-4-carboxamide

SMILES

CCOc(cc1)cc(NC(c2c(C)onc2-c(cccc2)c2Cl)=O)c1NC(c1ccccc1)=O

InChI

InChI=1S/C26H22ClN3O4/c1-3-33-18-13-14-21(28-25(31)17-9-5-4-6-10-17)22(15-18)29-26(32)23-16(2)34-30-24(23)19-11-7-8-12-20(19)27/h4-15H,3H2,1-2H3,(H,28,31)(H,29,32)

InChI Key

AXZVWKMNLMZQBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01933624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.93

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.924

Distribution Coefficient, logD

4.752

Water Solubility, LogSw

-5.05

Polar Surface Area

74.109

Acid Dissociation Constant (pKa)

7.71

Base Dissociation Constant (pKb)

-3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

K213-0063 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K213-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K213-0063?
Check Price and Availability of K213-0063, 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 K213-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K213-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K213-0063
  • 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 K213-0063 available by request