4363-0106 Screening compound: (1Z)-N-(4-bromophenyl)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine

4363-0106 Screening compound: (1Z)-N-(4-bromophenyl)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine
4363-0106 Screening compound: (1Z)-N-(4-bromophenyl)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4363-0106
(1Z)-N-(4-bromophenyl)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine

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

4363-0106

Molecular Formula

C19H21BrN2O2 (C19 H21 BrN2 O2)

Compound Name

(1Z)-N-(4-bromophenyl)-6,7-dimethoxy-3,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-imine

IUPAC name

(1Z)-N-(4-bromophenyl)-67-dimethoxy-33-dimethyl-1234-tetrahydroisoquinolin-1-imine

SMILES

CC(C)(Cc(cc1OC)c2cc1OC)N/C2=N\c(cc1)ccc1Br

InChI

InChI=1S/C19H21BrN2O2/c1-19(2)11-12-9-16(23-3)17(24-4)10-15(12)18(22-19)21-14-7-5-13(20)6-8-14/h5-10H,11H2,1-4H3,(H,21,22)

InChI Key

OZUMDPSJSVFOBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02130649

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.29

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.448

Distribution Coefficient, logD

3.755

Water Solubility, LogSw

-4.45

Polar Surface Area

34.384

Acid Dissociation Constant (pKa)

14.91

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

4363-0106 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4363-0106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4363-0106?
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What is the minimum amount of 4363-0106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4363-0106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4363-0106
  • 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 4363-0106 available by request