3807-2768 Screening compound: 4-phenyl-2,2-dipropyl-1H,2H,3H-benzo[f]isoindol-2-ium

3807-2768 Screening compound: 4-phenyl-2,2-dipropyl-1H,2H,3H-benzo[f]isoindol-2-ium
3807-2768 Screening compound: 4-phenyl-2,2-dipropyl-1H,2H,3H-benzo[f]isoindol-2-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-2768
4-phenyl-2,2-dipropyl-1H,2H,3H-benzo[f]isoindol-2-ium

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

3807-2768

Molecular Formula

C24H28N (C24 H28 N)

Compound Name

4-phenyl-2,2-dipropyl-1H,2H,3H-benzo[f]isoindol-2-ium

IUPAC name

4-phenyl-22-dipropyl-1H2H3H-benzo[f]isoindol-2-ium

SMILES

CCC[N+]1(CCC)Cc2c(-c3ccccc3)c3ccccc3cc2C1

InChI

InChI=1S/C24H28N/c1-3-14-25(15-4-2)17-21-16-20-12-8-9-13-22(20)24(23(21)18-25)19-10-6-5-7-11-19/h5-13,16H,3-4,14-15,17-18H2,1-2H3/q+1

InChI Key

PINCMEWVGXTYKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00484029

Chemical and Physical Properties

Saltdata

Br-

Molecular Weight

330.49

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

6.468

Distribution Coefficient, logD

6.468

Water Solubility, LogSw

-6.85

Polar Surface Area

0.805

Acid Dissociation Constant (pKa)

23.60

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

3807-2768 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 3807-2768 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-2768?
Check Price and Availability of 3807-2768, 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 3807-2768 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-2768
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-2768
  • 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 3807-2768 available by request