F794-1132 Screening compound: 5-[1-(3-chlorobenzenesulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

F794-1132 Screening compound: 5-[1-(3-chlorobenzenesulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
F794-1132 Screening compound: 5-[1-(3-chlorobenzenesulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F794-1132
5-[1-(3-chlorobenzenesulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-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

F794-1132

Molecular Formula

C19H16ClFN4O3S2 (C19 H16 ClFN4 O3 S2)

Compound Name

5-[1-(3-chlorobenzenesulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-[1-(3-chlorobenzenesulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-134-thiadiazole-2-carboxamide

SMILES

O=C(c1nnc(C(CCC2)N2S(c2cccc(Cl)c2)(=O)=O)s1)Nc(cccc1)c1F

InChI

InChI=1S/C19H16ClFN4O3S2/c20-12-5-3-6-13(11-12)30(27,28)25-10-4-9-16(25)18-23-24-19(29-18)17(26)22-15-8-2-1-7-14(15)21/h1-3,5-8,11,16H,4,9-10H2,(H,22,26)/t16-/m0/s1

InChI Key

UBRYLUWTLFODIG-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27190805

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.94

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.602

Distribution Coefficient, logD

3.597

Water Solubility, LogSw

-3.99

Polar Surface Area

78.412

Acid Dissociation Constant (pKa)

9.36

Base Dissociation Constant (pKb)

-2.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.10

F794-1132 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with F794-1132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F794-1132?
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What is the minimum amount of F794-1132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F794-1132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F794-1132
  • 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 F794-1132 available by request