V028-6905 Screening compound: 8-chloro-5-[3,4-dihydro-2(1H)-isoquinolinyl]-3-isopropyl[1,2,4]triazolo[4,3-c]quinazoline

V028-6905 Screening compound: 8-chloro-5-[3,4-dihydro-2(1H)-isoquinolinyl]-3-isopropyl[1,2,4]triazolo[4,3-c]quinazoline
V028-6905 Screening compound: 8-chloro-5-[3,4-dihydro-2(1H)-isoquinolinyl]-3-isopropyl[1,2,4]triazolo[4,3-c]quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6905
8-chloro-5-[3,4-dihydro-2(1H)-isoquinolinyl]-3-isopropyl[1,2,4]triazolo[4,3-c]quinazoline

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

V028-6905

Molecular Formula

C21H20ClN5 (C21 H20 ClN5)

Compound Name

8-chloro-5-[3,4-dihydro-2(1H)-isoquinolinyl]-3-isopropyl[1,2,4]triazolo[4,3-c]quinazoline

IUPAC name

n/a

SMILES

CC(C)c1nnc2n1c(N(CC1)Cc3c1cccc3)nc1c2ccc(Cl)c1

InChI

InChI=1S/C21H20ClN5/c1-13(2)19-24-25-20-17-8-7-16(22)11-18(17)23-21(27(19)20)26-10-9-14-5-3-4-6-15(14)12-26/h3-8,11,13H,9-10,12H2,1-2H3

InChI Key

YIKJHLVLYHZAER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19922696

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.88

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.346

Distribution Coefficient, logD

5.345

Water Solubility, LogSw

-6.04

Polar Surface Area

32.926

Acid Dissociation Constant (pKa)

17.28

Base Dissociation Constant (pKb)

4.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

V028-6905 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antifungal Library (16415 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Agro:
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V028-6905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6905?
Check Price and Availability of V028-6905, 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 V028-6905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6905
  • 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 V028-6905 available by request