8009-2848 Screening compound: 1-(3-chlorophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one

8009-2848 Screening compound: 1-(3-chlorophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one
8009-2848 Screening compound: 1-(3-chlorophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-2848
1-(3-chlorophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one

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

8009-2848

Molecular Formula

C15H12ClNO (C15 H12 ClNO)

Compound Name

1-(3-chlorophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one

IUPAC name

1-(3-chlorophenyl)-1234-tetrahydroisoquinolin-3-one

SMILES

O=C(C1)NC(c2cccc(Cl)c2)c2c1cccc2

InChI

InChI=1S/C15H12ClNO/c16-12-6-3-5-11(8-12)15-13-7-2-1-4-10(13)9-14(18)17-15/h1-8,15H,9H2,(H,17,18)/t15-/m0/s1

InChI Key

BPBYTLVKAVWKFQ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD01408042

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

257.72

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.251

Distribution Coefficient, logD

3.251

Water Solubility, LogSw

-3.45

Polar Surface Area

25.500

Acid Dissociation Constant (pKa)

10.78

Base Dissociation Constant (pKb)

-5.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.30

8009-2848 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

BRD4 Targeted Library (4534 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8009-2848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-2848?
Check Price and Availability of 8009-2848, 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 8009-2848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-2848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-2848
  • 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 8009-2848 available by request