4116-0036 Screening compound: 5-(2,6-dichlorophenyl)-1-ethyl-7,8-dimethoxy-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline

4116-0036 Screening compound: 5-(2,6-dichlorophenyl)-1-ethyl-7,8-dimethoxy-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline
4116-0036 Screening compound: 5-(2,6-dichlorophenyl)-1-ethyl-7,8-dimethoxy-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 4116-0036
5-(2,6-dichlorophenyl)-1-ethyl-7,8-dimethoxy-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline

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

4116-0036

Molecular Formula

C26H21Cl2N3O2 (C26 H21 Cl2 N3 O2)

Compound Name

5-(2,6-dichlorophenyl)-1-ethyl-7,8-dimethoxy-3-phenyl-3H-pyrazolo[3,4-c]isoquinoline

IUPAC name

5-(26-dichlorophenyl)-1-ethyl-78-dimethoxy-3-phenyl-3H-pyrazolo[34-c]isoquinoline

SMILES

CCc(c(c(c1c2)cc(OC)c2OC)c2nc1-c(c(Cl)ccc1)c1Cl)nn2-c1ccccc1

InChI

InChI=1S/C26H21Cl2N3O2/c1-4-20-23-16-13-21(32-2)22(33-3)14-17(16)25(24-18(27)11-8-12-19(24)28)29-26(23)31(30-20)15-9-6-5-7-10-15/h5-14H,4H2,1-3H3

InChI Key

PNBDRUHAPTUXQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01850592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.394

Distribution Coefficient, logD

6.393

Water Solubility, LogSw

-6.63

Polar Surface Area

39.811

Acid Dissociation Constant (pKa)

27.54

Base Dissociation Constant (pKb)

4.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 4116-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4116-0036?
Check Price and Availability of 4116-0036, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4116-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4116-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4116-0036
  • 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 4116-0036 available by request