V002-0002 Screening compound: ethyl 5-{4-[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazino}-5-oxopentanoate

V002-0002 Screening compound: ethyl 5-{4-[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazino}-5-oxopentanoate
V002-0002 Screening compound: ethyl 5-{4-[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazino}-5-oxopentanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-0002
ethyl 5-{4-[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazino}-5-oxopentanoate

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

V002-0002

Molecular Formula

C24H30N6O5 (C24 H30 N6 O5)

Compound Name

ethyl 5-{4-[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazino}-5-oxopentanoate

IUPAC name

ethyl 5-{4-[6-(34-dimethoxyphenyl)-[124]triazolo[15-a]pyrimidin-7-yl]piperazin-1-yl}-5-oxopentanoate

SMILES

CCOC(CCCC(N(CC1)CCN1c(n1ncnc1nc1)c1-c(cc1)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C24H30N6O5/c1-4-35-22(32)7-5-6-21(31)28-10-12-29(13-11-28)23-18(15-25-24-26-16-27-30(23)24)17-8-9-19(33-2)20(14-17)34-3/h8-9,14-16H,4-7,10-13H2,1-3H3

InChI Key

ILDLRQSRTNWNRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19971503

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

482.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.696

Distribution Coefficient, logD

1.688

Water Solubility, LogSw

-2.14

Polar Surface Area

85.868

Acid Dissociation Constant (pKa)

22.88

Base Dissociation Constant (pKb)

5.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.83

V002-0002 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with V002-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-0002?
Check Price and Availability of V002-0002, 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 V002-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-0002
  • 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 V002-0002 available by request