V021-6121 Screening compound: N-(3-chlorophenyl)-4-[3-(2-chlorophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide

V021-6121 Screening compound: N-(3-chlorophenyl)-4-[3-(2-chlorophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide
V021-6121 Screening compound: N-(3-chlorophenyl)-4-[3-(2-chlorophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6121
N-(3-chlorophenyl)-4-[3-(2-chlorophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide

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

V021-6121

Molecular Formula

C26H21Cl2N7O (C26 H21 Cl2 N7 O)

Compound Name

N-(3-chlorophenyl)-4-[3-(2-chlorophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazine-1-carboxamide

IUPAC name

N-(3-chlorophenyl)-4-[3-(2-chlorophenyl)-[124]triazolo[43-c]quinazolin-5-yl]piperazine-1-carboxamide

SMILES

O=C(Nc1cc(Cl)ccc1)N(CC1)CCN1c1nc(cccc2)c2c2nnc(-c(cccc3)c3Cl)n12

InChI

InChI=1S/C26H21Cl2N7O/c27-17-6-5-7-18(16-17)29-26(36)34-14-12-33(13-15-34)25-30-22-11-4-2-9-20(22)24-32-31-23(35(24)25)19-8-1-3-10-21(19)28/h1-11,16H,12-15H2,(H,29,36)

InChI Key

YAODYTDINHZYBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19924148

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

518.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.653

Distribution Coefficient, logD

5.588

Water Solubility, LogSw

-5.95

Polar Surface Area

58.270

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

6.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

V021-6121 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 V021-6121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6121?
Check Price and Availability of V021-6121, 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 V021-6121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6121
  • 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 V021-6121 available by request