P898-0374 Screening compound: N,N-dimethyl-5-(5-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}furan-2-yl)-1H-pyrazole-4-carboxamide

P898-0374 Screening compound: N,N-dimethyl-5-(5-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}furan-2-yl)-1H-pyrazole-4-carboxamide
P898-0374 Screening compound: N,N-dimethyl-5-(5-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}furan-2-yl)-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P898-0374
N,N-dimethyl-5-(5-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}furan-2-yl)-1H-pyrazole-4-carboxamide

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

P898-0374

Molecular Formula

C19H22N6O4S (C19 H22 N6 O4 S)

Compound Name

N,N-dimethyl-5-(5-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}furan-2-yl)-1H-pyrazole-4-carboxamide

IUPAC name

NN-dimethyl-5-(5-{[4-(pyridin-2-yl)piperazin-1-yl]sulfonyl}furan-2-yl)-1H-pyrazole-4-carboxamide

SMILES

CN(C)C(c1c(-c(o2)ccc2S(N(CC2)CCN2c2ncccc2)(=O)=O)[nH]nc1)=O

InChI

InChI=1S/C19H22N6O4S/c1-23(2)19(26)14-13-21-22-18(14)15-6-7-17(29-15)30(27,28)25-11-9-24(10-12-25)16-5-3-4-8-20-16/h3-8,13H,9-12H2,1-2H3,(H,21,22)

InChI Key

BFSHEGVPIIGKEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.120

Distribution Coefficient, logD

1.096

Water Solubility, LogSw

-2.34

Polar Surface Area

92.803

Acid Dissociation Constant (pKa)

6.34

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

P898-0374 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P898-0374 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P898-0374?
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What is the minimum amount of P898-0374 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P898-0374
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P898-0374
  • 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 P898-0374 available by request