D366-0056 Screening compound: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile

D366-0056 Screening compound: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
D366-0056 Screening compound: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound D366-0056
5-[4-(furan-2-carbonyl)piperazin-1-yl]-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile

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

D366-0056

Molecular Formula

C25H22N4O5 (C25 H22 N4 O5)

Compound Name

5-[4-(furan-2-carbonyl)piperazin-1-yl]-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile

IUPAC name

5-[4-(furan-2-carbonyl)piperazin-1-yl]-2-{5-[(4-methylphenoxy)methyl]furan-2-yl}-13-oxazole-4-carbonitrile

SMILES

Cc(cc1)ccc1OCc1ccc(-c2nc(C#N)c(N(CC3)CCN3C(c3ccco3)=O)o2)o1

InChI

InChI=1S/C25H22N4O5/c1-17-4-6-18(7-5-17)32-16-19-8-9-21(33-19)23-27-20(15-26)25(34-23)29-12-10-28(11-13-29)24(30)22-3-2-14-31-22/h2-9,14H,10-13,16H2,1H3

InChI Key

VDFFCIZENZVFTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14825489

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.921

Distribution Coefficient, logD

3.921

Water Solubility, LogSw

-3.86

Polar Surface Area

79.858

Acid Dissociation Constant (pKa)

27.44

Base Dissociation Constant (pKb)

-2.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

D366-0056 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D366-0056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D366-0056?
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What is the minimum amount of D366-0056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D366-0056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D366-0056
  • 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 D366-0056 available by request