F793-1496 Screening compound: N-(3,4-difluorophenyl)-5-{1-[(2,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide

F793-1496 Screening compound: N-(3,4-difluorophenyl)-5-{1-[(2,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide
F793-1496 Screening compound: N-(3,4-difluorophenyl)-5-{1-[(2,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F793-1496
N-(3,4-difluorophenyl)-5-{1-[(2,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}-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

F793-1496

Molecular Formula

C22H21F2N5O2S (C22 H21 F2 N5 O2 S)

Compound Name

N-(3,4-difluorophenyl)-5-{1-[(2,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(34-difluorophenyl)-5-{1-[(24-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}-134-thiadiazole-2-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(N(CCC1)C1c1nnc(C(Nc(cc2)cc(F)c2F)=O)s1)=O

InChI

InChI=1S/C22H21F2N5O2S/c1-12-5-8-17(13(2)10-12)26-22(31)29-9-3-4-18(29)20-27-28-21(32-20)19(30)25-14-6-7-15(23)16(24)11-14/h5-8,10-11,18H,3-4,9H2,1-2H3,(H,25,30)(H,26,31)/t18-/m0/s1

InChI Key

UPEYTFAOWBXMFE-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27190515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.392

Distribution Coefficient, logD

4.224

Water Solubility, LogSw

-4.20

Polar Surface Area

71.393

Acid Dissociation Constant (pKa)

7.72

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

F793-1496 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F793-1496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F793-1496?
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What is the minimum amount of F793-1496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F793-1496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F793-1496
  • 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 F793-1496 available by request