8014-9897 Screening compound: 3,4,5-trimethoxy-N~1~-[2-(2,2,2-trifluoroethoxy)ethyl]benzamide

8014-9897 Screening compound: 3,4,5-trimethoxy-N~1~-[2-(2,2,2-trifluoroethoxy)ethyl]benzamide
8014-9897 Screening compound: 3,4,5-trimethoxy-N~1~-[2-(2,2,2-trifluoroethoxy)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9897
3,4,5-trimethoxy-N~1~-[2-(2,2,2-trifluoroethoxy)ethyl]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

8014-9897

Molecular Formula

C14H18F3NO5 (C14 H18 F3 NO5)

Compound Name

3,4,5-trimethoxy-N~1~-[2-(2,2,2-trifluoroethoxy)ethyl]benzamide

IUPAC name

345-trimethoxy-N-[2-(222-trifluoroethoxy)ethyl]benzamide

SMILES

COc1cc(C(NCCOCC(F)(F)F)=O)cc(OC)c1OC

InChI

InChI=1S/C14H18F3NO5/c1-20-10-6-9(7-11(21-2)12(10)22-3)13(19)18-4-5-23-8-14(15,16)17/h6-7H,4-5,8H2,1-3H3,(H,18,19)

InChI Key

DUKJKFMHFVEPGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03821468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.597

Distribution Coefficient, logD

1.597

Water Solubility, LogSw

-1.90

Polar Surface Area

56.096

Acid Dissociation Constant (pKa)

14.67

Base Dissociation Constant (pKb)

-3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 8014-9897 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9897?
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What is the minimum amount of 8014-9897 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9897
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9897
  • 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 8014-9897 available by request