V021-9583 Screening compound: 1-cyclopentanecarbonyl-2-methyl-4-[3-(propan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine

V021-9583 Screening compound: 1-cyclopentanecarbonyl-2-methyl-4-[3-(propan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine
V021-9583 Screening compound: 1-cyclopentanecarbonyl-2-methyl-4-[3-(propan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-9583
1-cyclopentanecarbonyl-2-methyl-4-[3-(propan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine

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

V021-9583

Molecular Formula

C23H30N6O (C23 H30 N6 O)

Compound Name

1-cyclopentanecarbonyl-2-methyl-4-[3-(propan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine

IUPAC name

1-cyclopentanecarbonyl-2-methyl-4-[3-(propan-2-yl)-[124]triazolo[43-c]quinazolin-5-yl]piperazine

SMILES

CC(C)c1nnc2n1c(N(CC1)CC(C)N1C(C1CCCC1)=O)nc1c2cccc1

InChI

InChI=1S/C23H30N6O/c1-15(2)20-25-26-21-18-10-6-7-11-19(18)24-23(29(20)21)27-12-13-28(16(3)14-27)22(30)17-8-4-5-9-17/h6-7,10-11,15-17H,4-5,8-9,12-14H2,1-3H3/t16-/m0/s1

InChI Key

UTVRDOJHKRUZBH-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19923770

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

406.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.972

Distribution Coefficient, logD

3.970

Water Solubility, LogSw

-4.02

Polar Surface Area

49.497

Acid Dissociation Constant (pKa)

21.09

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.52

V021-9583 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V021-9583 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-9583?
Check Price and Availability of V021-9583, 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 V021-9583 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-9583
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-9583
  • 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 V021-9583 available by request