P593-0498 Screening compound: 3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-propyl-1H-pyrazole-4-carboxylic acid

P593-0498 Screening compound: 3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-propyl-1H-pyrazole-4-carboxylic acid
P593-0498 Screening compound: 3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-propyl-1H-pyrazole-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound P593-0498
3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-propyl-1H-pyrazole-4-carboxylic acid

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

P593-0498

Molecular Formula

C17H22N4O4S (C17 H22 N4 O4 S)

Compound Name

3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-propyl-1H-pyrazole-4-carboxylic acid

IUPAC name

3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-propyl-1H-pyrazole-4-carboxylic acid

SMILES

CCCn(cc1C(O)=O)nc1S(N(CC1)CCN1c1ccccc1)(=O)=O

InChI

InChI=1S/C17H22N4O4S/c1-2-8-20-13-15(17(22)23)16(18-20)26(24,25)21-11-9-19(10-12-21)14-6-4-3-5-7-14/h3-7,13H,2,8-12H2,1H3,(H,22,23)

InChI Key

YABQTQRKUPDXIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27605953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.061

Distribution Coefficient, logD

-2.045

Water Solubility, LogSw

-2.53

Polar Surface Area

78.695

Acid Dissociation Constant (pKa)

3.29

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

P593-0498 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with P593-0498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P593-0498?
Check Price and Availability of P593-0498, 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 P593-0498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P593-0498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P593-0498
  • 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 P593-0498 available by request