G706-1673 Screening compound: 2-(propan-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-benzoxazole-6-carboxamide

G706-1673 Screening compound: 2-(propan-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-benzoxazole-6-carboxamide
G706-1673 Screening compound: 2-(propan-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-benzoxazole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G706-1673
2-(propan-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-benzoxazole-6-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

G706-1673

Molecular Formula

C18H15F3N2O2 (C18 H15 F3 N2 O2)

Compound Name

2-(propan-2-yl)-N-[3-(trifluoromethyl)phenyl]-1,3-benzoxazole-6-carboxamide

IUPAC name

2-(propan-2-yl)-N-[3-(trifluoromethyl)phenyl]-13-benzoxazole-6-carboxamide

SMILES

CC(C)c1nc(ccc(C(Nc2cccc(C(F)(F)F)c2)=O)c2)c2o1

InChI

InChI=1S/C18H15F3N2O2/c1-10(2)17-23-14-7-6-11(8-15(14)25-17)16(24)22-13-5-3-4-12(9-13)18(19,20)21/h3-10H,1-2H3,(H,22,24)

InChI Key

KMUDVLXGZPUOIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27152570

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.285

Distribution Coefficient, logD

5.276

Water Solubility, LogSw

-5.40

Polar Surface Area

40.411

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

G706-1673 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular

References: we are preparing a list of scientific research reports with G706-1673 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G706-1673?
Check Price and Availability of G706-1673, 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 G706-1673 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G706-1673
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G706-1673
  • 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 G706-1673 available by request