D337-2022 Screening compound: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide

D337-2022 Screening compound: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide
D337-2022 Screening compound: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D337-2022
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-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

D337-2022

Molecular Formula

C21H19N3O3S (C21 H19 N3 O3 S)

Compound Name

N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide

IUPAC name

N-(46-dimethyl-13-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-12-oxazole-3-carboxamide

SMILES

CCOc(cc1)ccc1-c1cc(C(Nc2nc(c(C)cc(C)c3)c3s2)=O)no1

InChI

InChI=1S/C21H19N3O3S/c1-4-26-15-7-5-14(6-8-15)17-11-16(24-27-17)20(25)23-21-22-19-13(3)9-12(2)10-18(19)28-21/h5-11H,4H2,1-3H3,(H,22,23,25)

InChI Key

KNCZFEZZDRYIKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12914668

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.917

Distribution Coefficient, logD

5.917

Water Solubility, LogSw

-5.44

Polar Surface Area

62.520

Acid Dissociation Constant (pKa)

10.95

Base Dissociation Constant (pKb)

0.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

D337-2022 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D337-2022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D337-2022?
Check Price and Availability of D337-2022, 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 D337-2022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D337-2022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D337-2022
  • 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 D337-2022 available by request