V007-9811 Screening compound: 2-(2,4-difluorobenzoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinoline

V007-9811 Screening compound: 2-(2,4-difluorobenzoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinoline
V007-9811 Screening compound: 2-(2,4-difluorobenzoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-9811
2-(2,4-difluorobenzoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinoline

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

V007-9811

Molecular Formula

C22H16F3NO (C22 H16 F3 NO)

Compound Name

2-(2,4-difluorobenzoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-(24-difluorobenzoyl)-1-(4-fluorophenyl)-1234-tetrahydroisoquinoline

SMILES

O=C(c(ccc(F)c1)c1F)N(CC1)C(c(cc2)ccc2F)c2c1cccc2

InChI

InChI=1S/C22H16F3NO/c23-16-7-5-15(6-8-16)21-18-4-2-1-3-14(18)11-12-26(21)22(27)19-10-9-17(24)13-20(19)25/h1-10,13,21H,11-12H2/t21-/m0/s1

InChI Key

LEUGVYZILKIYSY-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19957669

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.37

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.469

Distribution Coefficient, logD

5.469

Water Solubility, LogSw

-5.84

Polar Surface Area

15.861

Acid Dissociation Constant (pKa)

20.68

Base Dissociation Constant (pKb)

-7.70

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

V007-9811 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V007-9811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-9811?
Check Price and Availability of V007-9811, 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 V007-9811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-9811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-9811
  • 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 V007-9811 available by request