1491-0950 Screening compound: 5-(dimethylamino)-2-phenyl-1,3-oxazole-4-carbonitrile

1491-0950 Screening compound: 5-(dimethylamino)-2-phenyl-1,3-oxazole-4-carbonitrile
1491-0950 Screening compound: 5-(dimethylamino)-2-phenyl-1,3-oxazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 1491-0950
5-(dimethylamino)-2-phenyl-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

1491-0950

Molecular Formula

C12H11N3O (C12 H11 N3 O)

Compound Name

5-(dimethylamino)-2-phenyl-1,3-oxazole-4-carbonitrile

IUPAC name

5-(dimethylamino)-2-phenyl-13-oxazole-4-carbonitrile

SMILES

CN(C)c1c(C#N)nc(-c2ccccc2)o1

InChI

InChI=1S/C12H11N3O/c1-15(2)12-10(8-13)14-11(16-12)9-6-4-3-5-7-9/h3-7H,1-2H3

InChI Key

YXOHQILNFAPXOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00522015

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

213.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.113

Distribution Coefficient, logD

2.113

Water Solubility, LogSw

-2.14

Polar Surface Area

39.107

Acid Dissociation Constant (pKa)

29.83

Base Dissociation Constant (pKb)

-4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

1491-0950 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Frequent Hitters Library (7624 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Soluble Diversity Library (15920 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Structure:
  • Fragments
  • Pool
Targets:
  • Ion Channels
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1491-0950 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1491-0950?
Check Price and Availability of 1491-0950, 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 1491-0950 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1491-0950
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1491-0950
  • 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 1491-0950 available by request