4340-2123 Screening compound: 2-(4-methylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazole-4-carbonitrile

4340-2123 Screening compound: 2-(4-methylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazole-4-carbonitrile
4340-2123 Screening compound: 2-(4-methylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 4340-2123
2-(4-methylphenyl)-5-{[(4-methylphenyl)methyl]amino}-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

4340-2123

Molecular Formula

C19H17N3O (C19 H17 N3 O)

Compound Name

2-(4-methylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazole-4-carbonitrile

IUPAC name

2-(4-methylphenyl)-5-{[(4-methylphenyl)methyl]amino}-13-oxazole-4-carbonitrile

SMILES

Cc1ccc(CNc2c(C#N)nc(-c3ccc(C)cc3)o2)cc1

InChI

InChI=1S/C19H17N3O/c1-13-3-7-15(8-4-13)12-21-19-17(11-20)22-18(23-19)16-9-5-14(2)6-10-16/h3-10,21H,12H2,1-2H3

InChI Key

ZNKOGEGXHOAHNI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02970006

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.199

Distribution Coefficient, logD

4.199

Water Solubility, LogSw

-4.21

Polar Surface Area

46.278

Acid Dissociation Constant (pKa)

15.33

Base Dissociation Constant (pKb)

-5.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

4340-2123 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4340-2123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4340-2123?
Check Price and Availability of 4340-2123, 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 4340-2123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4340-2123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4340-2123
  • 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 4340-2123 available by request