Y070-4519 Screening compound: 2-(4-tert-butylphenyl)-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile

Y070-4519 Screening compound: 2-(4-tert-butylphenyl)-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
Y070-4519 Screening compound: 2-(4-tert-butylphenyl)-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-4519
2-(4-tert-butylphenyl)-5-(4-ethylpiperazin-1-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

Y070-4519

Molecular Formula

C20H26N4O (C20 H26 N4 O)

Compound Name

2-(4-tert-butylphenyl)-5-(4-ethylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile

IUPAC name

2-(4-tert-butylphenyl)-5-(4-ethylpiperazin-1-yl)-13-oxazole-4-carbonitrile

SMILES

CCN(CC1)CCN1c1c(C#N)nc(-c2ccc(C(C)(C)C)cc2)o1

InChI

InChI=1S/C20H26N4O/c1-5-23-10-12-24(13-11-23)19-17(14-21)22-18(25-19)15-6-8-16(9-7-15)20(2,3)4/h6-9H,5,10-13H2,1-4H3

InChI Key

CHAVOGJEGMQJDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04161062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.301

Distribution Coefficient, logD

3.824

Water Solubility, LogSw

-4.05

Polar Surface Area

43.291

Acid Dissociation Constant (pKa)

27.25

Base Dissociation Constant (pKb)

7.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y070-4519 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y070-4519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-4519?
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What is the minimum amount of Y070-4519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-4519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-4519
  • 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 Y070-4519 available by request