P970-1080 Screening compound: N-methyl-N-[(4-methyloxan-4-yl)methyl]-2-(trifluoromethoxy)benzamide

P970-1080 Screening compound: N-methyl-N-[(4-methyloxan-4-yl)methyl]-2-(trifluoromethoxy)benzamide
P970-1080 Screening compound: N-methyl-N-[(4-methyloxan-4-yl)methyl]-2-(trifluoromethoxy)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P970-1080
N-methyl-N-[(4-methyloxan-4-yl)methyl]-2-(trifluoromethoxy)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

P970-1080

Molecular Formula

C16H20F3NO3 (C16 H20 F3 NO3)

Compound Name

N-methyl-N-[(4-methyloxan-4-yl)methyl]-2-(trifluoromethoxy)benzamide

IUPAC name

N-methyl-N-[(4-methyloxan-4-yl)methyl]-2-(trifluoromethoxy)benzamide

SMILES

CC1(CN(C)C(c(cccc2)c2OC(F)(F)F)=O)CCOCC1

InChI

InChI=1S/C16H20F3NO3/c1-15(7-9-22-10-8-15)11-20(2)14(21)12-5-3-4-6-13(12)23-16(17,18)19/h3-6H,7-11H2,1-2H3

InChI Key

MMLSHKJNRZYHIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28995443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.224

Distribution Coefficient, logD

3.224

Water Solubility, LogSw

-3.60

Polar Surface Area

30.513

Acid Dissociation Constant (pKa)

28.89

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

P970-1080 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P970-1080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P970-1080?
Check Price and Availability of P970-1080, 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 P970-1080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P970-1080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P970-1080
  • 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 P970-1080 available by request