D337-0096 Screening compound: ethyl 4-methyl-2-(5-phenyl-1,2-oxazole-3-amido)-1,3-thiazole-5-carboxylate

D337-0096 Screening compound: ethyl 4-methyl-2-(5-phenyl-1,2-oxazole-3-amido)-1,3-thiazole-5-carboxylate
D337-0096 Screening compound: ethyl 4-methyl-2-(5-phenyl-1,2-oxazole-3-amido)-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D337-0096
ethyl 4-methyl-2-(5-phenyl-1,2-oxazole-3-amido)-1,3-thiazole-5-carboxylate

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

D337-0096

Molecular Formula

C17H15N3O4S (C17 H15 N3 O4 S)

Compound Name

ethyl 4-methyl-2-(5-phenyl-1,2-oxazole-3-amido)-1,3-thiazole-5-carboxylate

IUPAC name

ethyl 4-methyl-2-(5-phenyl-12-oxazole-3-amido)-13-thiazole-5-carboxylate

SMILES

CCOC(c1c(C)nc(NC(c2noc(-c3ccccc3)c2)=O)s1)=O

InChI

InChI=1S/C17H15N3O4S/c1-3-23-16(22)14-10(2)18-17(25-14)19-15(21)12-9-13(24-20-12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,18,19,21)

InChI Key

LFXCXWREPDYESZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12914774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.946

Distribution Coefficient, logD

3.873

Water Solubility, LogSw

-3.99

Polar Surface Area

76.242

Acid Dissociation Constant (pKa)

8.14

Base Dissociation Constant (pKb)

-0.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

D337-0096 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D337-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D337-0096?
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What is the minimum amount of D337-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D337-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D337-0096
  • 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 D337-0096 available by request