P877-0073 Screening compound: 1-(2,5-difluorobenzenesulfonyl)-4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazine

P877-0073 Screening compound: 1-(2,5-difluorobenzenesulfonyl)-4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazine
P877-0073 Screening compound: 1-(2,5-difluorobenzenesulfonyl)-4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound P877-0073
1-(2,5-difluorobenzenesulfonyl)-4-[3-(pyridin-4-yl)-1H-pyrazol-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

P877-0073

Molecular Formula

C18H17F2N5O2S (C18 H17 F2 N5 O2 S)

Compound Name

1-(2,5-difluorobenzenesulfonyl)-4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazine

IUPAC name

1-(25-difluorobenzenesulfonyl)-4-[3-(pyridin-4-yl)-1H-pyrazol-5-yl]piperazine

SMILES

O=S(c(cc(cc1)F)c1F)(N(CC1)CCN1c1cc(-c2ccncc2)n[nH]1)=O

InChI

InChI=1S/C18H17F2N5O2S/c19-14-1-2-15(20)17(11-14)28(26,27)25-9-7-24(8-10-25)18-12-16(22-23-18)13-3-5-21-6-4-13/h1-6,11-12H,7-10H2,(H,22,23)

InChI Key

QOCLTFUOAZQTEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27615822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.479

Distribution Coefficient, logD

2.478

Water Solubility, LogSw

-2.70

Polar Surface Area

66.591

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

P877-0073 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with P877-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P877-0073?
Check Price and Availability of P877-0073, 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 P877-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P877-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P877-0073
  • 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 P877-0073 available by request