P899-0071 Screening compound: N-[(4-fluorophenyl)methyl]-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide

P899-0071 Screening compound: N-[(4-fluorophenyl)methyl]-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide
P899-0071 Screening compound: N-[(4-fluorophenyl)methyl]-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P899-0071
N-[(4-fluorophenyl)methyl]-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide

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

P899-0071

Molecular Formula

C20H21FN4O4S (C20 H21 FN4 O4 S)

Compound Name

N-[(4-fluorophenyl)methyl]-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide

IUPAC name

N-[(4-fluorophenyl)methyl]-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide

SMILES

Cc(oc(-c([nH]nc1)c1C(N1CCCC1)=O)c1)c1S(NCc(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C20H21FN4O4S/c1-13-18(30(27,28)23-11-14-4-6-15(21)7-5-14)10-17(29-13)19-16(12-22-24-19)20(26)25-8-2-3-9-25/h4-7,10,12,23H,2-3,8-9,11H2,1H3,(H,22,24)

InChI Key

QFOWUZCUIVIWMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.388

Distribution Coefficient, logD

2.387

Water Solubility, LogSw

-2.94

Polar Surface Area

91.526

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

P899-0071 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P899-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P899-0071?
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What is the minimum amount of P899-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P899-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P899-0071
  • 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 P899-0071 available by request