8014-1633 Screening compound: N-(2-{[(Z)-[1-amino-2-(3,4-diethoxyphenyl)ethylidene]amino]oxy}-1,1,1,3,3,3-hexafluoropropan-2-yl)thiophene-2-carboxamide

8014-1633 Screening compound: N-(2-{[(Z)-[1-amino-2-(3,4-diethoxyphenyl)ethylidene]amino]oxy}-1,1,1,3,3,3-hexafluoropropan-2-yl)thiophene-2-carboxamide
8014-1633 Screening compound: N-(2-{[(Z)-[1-amino-2-(3,4-diethoxyphenyl)ethylidene]amino]oxy}-1,1,1,3,3,3-hexafluoropropan-2-yl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-1633
N-(2-{[(Z)-[1-amino-2-(3,4-diethoxyphenyl)ethylidene]amino]oxy}-1,1,1,3,3,3-hexafluoropropan-2-yl)thiophene-2-carboxamide

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

8014-1633

Molecular Formula

C20H21F6N3O4S (C20 H21 F6 N3 O4 S)

Compound Name

N-(2-{[(Z)-[1-amino-2-(3,4-diethoxyphenyl)ethylidene]amino]oxy}-1,1,1,3,3,3-hexafluoropropan-2-yl)thiophene-2-carboxamide

IUPAC name

N-(2-{[(Z)-[1-amino-2-(34-diethoxyphenyl)ethylidene]amino]oxy}-111333-hexafluoropropan-2-yl)thiophene-2-carboxamide

SMILES

CCOc(ccc(C/C(/N)=N/OC(C(F)(F)F)(C(F)(F)F)NC(c1cccs1)=O)c1)c1OCC

InChI

InChI=1S/C20H21F6N3O4S/c1-3-31-13-8-7-12(10-14(13)32-4-2)11-16(27)29-33-18(19(21,22)23,20(24,25)26)28-17(30)15-6-5-9-34-15/h5-10H,3-4,11H2,1-2H3,(H2,27,29)(H,28,30)

InChI Key

AOEXFLQIIKDZHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03767843

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.842

Distribution Coefficient, logD

-0.459

Water Solubility, LogSw

-4.10

Polar Surface Area

78.135

Acid Dissociation Constant (pKa)

3.10

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with 8014-1633 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-1633?
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What is the minimum amount of 8014-1633 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-1633
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-1633
  • 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 8014-1633 available by request