8014-9725 Screening compound: 7-chloro-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-6-yl acetate

8014-9725 Screening compound: 7-chloro-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-6-yl acetate
8014-9725 Screening compound: 7-chloro-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-6-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9725
7-chloro-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-6-yl acetate

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

8014-9725

Molecular Formula

C10H10ClF6NO2 (C10 H10 ClF6 NO2)

Compound Name

7-chloro-3,3-bis(trifluoromethyl)-2-azabicyclo[2.2.1]hept-6-yl acetate

IUPAC name

7-chloro-33-bis(trifluoromethyl)-2-azabicyclo[2.2.1]heptan-6-yl acetate

SMILES

CC(OC(CC1C2Cl)C2NC1(C(F)(F)F)C(F)(F)F)=O

InChI

InChI=1S/C10H10ClF6NO2/c1-3(19)20-5-2-4-6(11)7(5)18-8(4,9(12,13)14)10(15,16)17/h4-7,18H,2H2,1H3

InChI Key

MALAWQUOUSCHNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00298642

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.64

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.257

Distribution Coefficient, logD

3.257

Water Solubility, LogSw

-3.39

Polar Surface Area

34.498

Acid Dissociation Constant (pKa)

15.54

Base Dissociation Constant (pKb)

-3.40

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

90.00

References: we are preparing a list of scientific research reports with 8014-9725 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9725?
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What is the minimum amount of 8014-9725 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9725
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9725
  • 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 8014-9725 available by request