P899-0056 Screening compound: N-(3,4-dimethylphenyl)-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide

P899-0056 Screening compound: N-(3,4-dimethylphenyl)-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide
P899-0056 Screening compound: N-(3,4-dimethylphenyl)-2-methyl-5-[4-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]furan-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P899-0056
N-(3,4-dimethylphenyl)-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

P899-0056

Molecular Formula

C21H24N4O4S (C21 H24 N4 O4 S)

Compound Name

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

IUPAC name

N-(34-dimethylphenyl)-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(Nc1cc(C)c(C)cc1)(=O)=O

InChI

InChI=1S/C21H24N4O4S/c1-13-6-7-16(10-14(13)2)24-30(27,28)19-11-18(29-15(19)3)20-17(12-22-23-20)21(26)25-8-4-5-9-25/h6-7,10-12,24H,4-5,8-9H2,1-3H3,(H,22,23)

InChI Key

RDDSREMKAJZMRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29026786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.420

Distribution Coefficient, logD

3.411

Water Solubility, LogSw

-3.58

Polar Surface Area

90.418

Acid Dissociation Constant (pKa)

9.08

Base Dissociation Constant (pKb)

3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

P899-0056 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 P899-0056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P899-0056?
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What is the minimum amount of P899-0056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P899-0056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P899-0056
  • 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 P899-0056 available by request