G856-3516 Screening compound: 3-(2-chlorophenyl)-6-[3,4-dihydro-2(1H)-isoquinolinyl]-2,4(1H,3H)-pyrimidinedione

G856-3516 Screening compound: 3-(2-chlorophenyl)-6-[3,4-dihydro-2(1H)-isoquinolinyl]-2,4(1H,3H)-pyrimidinedione
G856-3516 Screening compound: 3-(2-chlorophenyl)-6-[3,4-dihydro-2(1H)-isoquinolinyl]-2,4(1H,3H)-pyrimidinedione alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-3516
3-(2-chlorophenyl)-6-[3,4-dihydro-2(1H)-isoquinolinyl]-2,4(1H,3H)-pyrimidinedione

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

G856-3516

Molecular Formula

C19H16ClN3O2 (C19 H16 ClN3 O2)

Compound Name

3-(2-chlorophenyl)-6-[3,4-dihydro-2(1H)-isoquinolinyl]-2,4(1H,3H)-pyrimidinedione

IUPAC name

n/a

SMILES

O=C(C=C(N1)N(CC2)Cc3c2cccc3)N(c(cccc2)c2Cl)C1=O

InChI

InChI=1S/C19H16ClN3O2/c20-15-7-3-4-8-16(15)23-18(24)11-17(21-19(23)25)22-10-9-13-5-1-2-6-14(13)12-22/h1-8,11H,9-10,12H2,(H,21,25)

InChI Key

DBJJSKKSNCXRBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04471876

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.81

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.147

Distribution Coefficient, logD

3.128

Water Solubility, LogSw

-3.46

Polar Surface Area

43.068

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

-4.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

G856-3516 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G856-3516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-3516?
Check Price and Availability of G856-3516, 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 G856-3516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-3516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-3516
  • 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 G856-3516 available by request