T992-1613 Screening compound: 2-cyclobutyl-5-methyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,3-oxazole-4-carboxamide

T992-1613 Screening compound: 2-cyclobutyl-5-methyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,3-oxazole-4-carboxamide
T992-1613 Screening compound: 2-cyclobutyl-5-methyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T992-1613
2-cyclobutyl-5-methyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,3-oxazole-4-carboxamide

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

T992-1613

Molecular Formula

C17H17F3N2O2 (C17 H17 F3 N2 O2)

Compound Name

2-cyclobutyl-5-methyl-N-{[2-(trifluoromethyl)phenyl]methyl}-1,3-oxazole-4-carboxamide

IUPAC name

2-cyclobutyl-5-methyl-N-{[2-(trifluoromethyl)phenyl]methyl}-13-oxazole-4-carboxamide

SMILES

Cc1c(C(NCc2c(C(F)(F)F)cccc2)=O)nc(C2CCC2)o1

InChI

InChI=1S/C17H17F3N2O2/c1-10-14(22-16(24-10)11-6-4-7-11)15(23)21-9-12-5-2-3-8-13(12)17(18,19)20/h2-3,5,8,11H,4,6-7,9H2,1H3,(H,21,23)

InChI Key

HZODFJGWJCZDHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29029171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.689

Distribution Coefficient, logD

3.689

Water Solubility, LogSw

-3.89

Polar Surface Area

42.802

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

T992-1613 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with T992-1613 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T992-1613?
Check Price and Availability of T992-1613, 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 T992-1613 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T992-1613
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T992-1613
  • 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 T992-1613 available by request