V016-6525 Screening compound: ethyl 5-{4-[4-(2-methylpentanoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

V016-6525 Screening compound: ethyl 5-{4-[4-(2-methylpentanoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate
V016-6525 Screening compound: ethyl 5-{4-[4-(2-methylpentanoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-6525
ethyl 5-{4-[4-(2-methylpentanoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

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

V016-6525

Molecular Formula

C27H33N5O3 (C27 H33 N5 O3)

Compound Name

ethyl 5-{4-[4-(2-methylpentanoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

IUPAC name

ethyl 5-{4-[4-(2-methylpentanoyl)piperazin-1-yl]phenyl}-1-(pyridin-2-yl)-1H-pyrazole-3-carboxylate

SMILES

CCCC(C)C(N(CC1)CCN1c(cc1)ccc1-c1cc(C(OCC)=O)nn1-c1ncccc1)=O

InChI

InChI=1S/C27H33N5O3/c1-4-8-20(3)26(33)31-17-15-30(16-18-31)22-12-10-21(11-13-22)24-19-23(27(34)35-5-2)29-32(24)25-9-6-7-14-28-25/h6-7,9-14,19-20H,4-5,8,15-18H2,1-3H3/t20-/m0/s1

InChI Key

QDFKSWIMPIFXGP-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19955577

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

475.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.821

Distribution Coefficient, logD

4.821

Water Solubility, LogSw

-4.56

Polar Surface Area

62.507

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

2.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

V016-6525 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V016-6525 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-6525?
Check Price and Availability of V016-6525, 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 V016-6525 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-6525
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-6525
  • 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 V016-6525 available by request