8503-0162 Screening compound: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2,2,2-trifluoroacetamide

8503-0162 Screening compound: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2,2,2-trifluoroacetamide
8503-0162 Screening compound: N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2,2,2-trifluoroacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8503-0162
N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2,2,2-trifluoroacetamide

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

8503-0162

Molecular Formula

C17H12ClF3N2O2 (C17 H12 ClF3 N2 O2)

Compound Name

N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2,2,2-trifluoroacetamide

IUPAC name

N-[4-chloro-3-(57-dimethyl-13-benzoxazol-2-yl)phenyl]-222-trifluoroacetamide

SMILES

Cc(cc1C)cc2c1oc(-c(cc(cc1)NC(C(F)(F)F)=O)c1Cl)n2

InChI

InChI=1S/C17H12ClF3N2O2/c1-8-5-9(2)14-13(6-8)23-15(25-14)11-7-10(3-4-12(11)18)22-16(24)17(19,20)21/h3-7H,1-2H3,(H,22,24)

InChI Key

KROHBAOASHATJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07175748

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.74

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.257

Distribution Coefficient, logD

5.051

Water Solubility, LogSw

-5.73

Polar Surface Area

40.644

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

-1.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with 8503-0162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8503-0162?
Check Price and Availability of 8503-0162, 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 8503-0162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8503-0162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8503-0162
  • 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 8503-0162 available by request