V025-6697 Screening compound: N-(butan-2-yl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide

V025-6697 Screening compound: N-(butan-2-yl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide
V025-6697 Screening compound: N-(butan-2-yl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-6697
N-(butan-2-yl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide

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

V025-6697

Molecular Formula

C28H36N6O3 (C28 H36 N6 O3)

Compound Name

N-(butan-2-yl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide

IUPAC name

N-(butan-2-yl)-N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide

SMILES

CCC(C)N(Cc(c(C)nn1-c2ccccc2)c1N1CCN(CC)CC1)C(c1cccc([N+]([O-])=O)c1)=O

InChI

InChI=1S/C28H36N6O3/c1-5-21(3)32(28(35)23-11-10-14-25(19-23)34(36)37)20-26-22(4)29-33(24-12-8-7-9-13-24)27(26)31-17-15-30(6-2)16-18-31/h7-14,19,21H,5-6,15-18,20H2,1-4H3/t21-/m0/s1

InChI Key

KEVGTAADHZBNLT-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19941951

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

504.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.823

Distribution Coefficient, logD

2.754

Water Solubility, LogSw

-4.61

Polar Surface Area

69.372

Acid Dissociation Constant (pKa)

23.92

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with V025-6697 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-6697?
Check Price and Availability of V025-6697, 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 V025-6697 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-6697
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-6697
  • 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 V025-6697 available by request