3555-0234 Screening compound: N'-[(1Z)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-ylidene]-2,2,3,3-tetrafluoropropanehydrazide

3555-0234 Screening compound: N'-[(1Z)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-ylidene]-2,2,3,3-tetrafluoropropanehydrazide
3555-0234 Screening compound: N'-[(1Z)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-ylidene]-2,2,3,3-tetrafluoropropanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3555-0234
N'-[(1Z)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-ylidene]-2,2,3,3-tetrafluoropropanehydrazide

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

3555-0234

Molecular Formula

C16H19F4N3O3 (C16 H19 F4 N3 O3)

Compound Name

N'-[(1Z)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-ylidene]-2,2,3,3-tetrafluoropropanehydrazide

IUPAC name

N'-[(1Z)-67-dimethoxy-33-dimethyl-1234-tetrahydroisoquinolin-1-ylidene]-2233-tetrafluoropropanehydrazide

SMILES

CC(C)(Cc(cc1OC)c2cc1OC)N/C2=N\NC(C(C(F)F)(F)F)=O

InChI

InChI=1S/C16H19F4N3O3/c1-15(2)7-8-5-10(25-3)11(26-4)6-9(8)12(21-15)22-23-14(24)16(19,20)13(17)18/h5-6,13H,7H2,1-4H3,(H,21,22)(H,23,24)

InChI Key

PTYIJINWRLBNDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02130625

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.692

Distribution Coefficient, logD

0.584

Water Solubility, LogSw

-3.04

Polar Surface Area

61.802

Acid Dissociation Constant (pKa)

9.12

Base Dissociation Constant (pKb)

7.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 3555-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3555-0234?
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What is the minimum amount of 3555-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3555-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3555-0234
  • 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 3555-0234 available by request