Y205-0526 Screening compound: 3,5-dimethyl-N~1~-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide

Y205-0526 Screening compound: 3,5-dimethyl-N~1~-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide
Y205-0526 Screening compound: 3,5-dimethyl-N~1~-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-0526
3,5-dimethyl-N~1~-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide

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

Y205-0526

Molecular Formula

C17H15F3N2O4 (C17 H15 F3 N2 O4)

Compound Name

3,5-dimethyl-N~1~-[3-nitro-5-(2,2,2-trifluoroethoxy)phenyl]benzamide

IUPAC name

35-dimethyl-N-[3-nitro-5-(222-trifluoroethoxy)phenyl]benzamide

SMILES

Cc1cc(C(Nc2cc(OCC(F)(F)F)cc([N+]([O-])=O)c2)=O)cc(C)c1

InChI

InChI=1S/C17H15F3N2O4/c1-10-3-11(2)5-12(4-10)16(23)21-13-6-14(22(24)25)8-15(7-13)26-9-17(18,19)20/h3-8H,9H2,1-2H3,(H,21,23)

InChI Key

QYMIUOVRNNPABI-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.864

Distribution Coefficient, logD

3.943

Water Solubility, LogSw

-4.66

Polar Surface Area

64.210

Acid Dissociation Constant (pKa)

6.53

Base Dissociation Constant (pKb)

-2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.53

References: we are preparing a list of scientific research reports with Y205-0526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-0526?
Check Price and Availability of Y205-0526, 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 Y205-0526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-0526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-0526
  • 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 Y205-0526 available by request