F322-0871 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophen-3-yl]sulfonyl}piperazine

F322-0871 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophen-3-yl]sulfonyl}piperazine
F322-0871 Screening compound: 1-(5-chloro-2-methylphenyl)-4-{[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophen-3-yl]sulfonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound F322-0871
1-(5-chloro-2-methylphenyl)-4-{[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophen-3-yl]sulfonyl}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

F322-0871

Molecular Formula

C22H26ClN3O3S2 (C22 H26 ClN3 O3 S2)

Compound Name

1-(5-chloro-2-methylphenyl)-4-{[4-(3,4-dimethyl-1,2-oxazol-5-yl)-2,5-dimethylthiophen-3-yl]sulfonyl}piperazine

IUPAC name

1-(5-chloro-2-methylphenyl)-4-{[4-(34-dimethyl-12-oxazol-5-yl)-25-dimethylthiophen-3-yl]sulfonyl}piperazine

SMILES

Cc1c(-c2c(C)sc(C)c2S(N(CC2)CCN2c2c(C)ccc(Cl)c2)(=O)=O)onc1C

InChI

InChI=1S/C22H26ClN3O3S2/c1-13-6-7-18(23)12-19(13)25-8-10-26(11-9-25)31(27,28)22-17(5)30-16(4)20(22)21-14(2)15(3)24-29-21/h6-7,12H,8-11H2,1-5H3

InChI Key

UUSRRZSCCDXNBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27115907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.05

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.468

Distribution Coefficient, logD

5.468

Water Solubility, LogSw

-6.20

Polar Surface Area

58.272

Acid Dissociation Constant (pKa)

23.71

Base Dissociation Constant (pKb)

2.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

F322-0871 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F322-0871 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F322-0871?
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What is the minimum amount of F322-0871 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F322-0871
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F322-0871
  • 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 F322-0871 available by request