F793-0211 Screening compound: N-(4-chlorophenyl)-5-(1-{[3-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide

F793-0211 Screening compound: N-(4-chlorophenyl)-5-(1-{[3-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
F793-0211 Screening compound: N-(4-chlorophenyl)-5-(1-{[3-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F793-0211
N-(4-chlorophenyl)-5-(1-{[3-(trifluoromethyl)phenyl]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

F793-0211

Molecular Formula

C21H17ClF3N5O2S (C21 H17 ClF3 N5 O2 S)

Compound Name

N-(4-chlorophenyl)-5-(1-{[3-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(4-chlorophenyl)-5-(1-{[3-(trifluoromethyl)phenyl]carbamoyl}pyrrolidin-2-yl)-134-thiadiazole-2-carboxamide

SMILES

O=C(c1nnc(C(CCC2)N2C(Nc2cc(C(F)(F)F)ccc2)=O)s1)Nc(cc1)ccc1Cl

InChI

InChI=1S/C21H17ClF3N5O2S/c22-13-6-8-14(9-7-13)26-17(31)19-29-28-18(33-19)16-5-2-10-30(16)20(32)27-15-4-1-3-12(11-15)21(23,24)25/h1,3-4,6-9,11,16H,2,5,10H2,(H,26,31)(H,27,32)/t16-/m0/s1

InChI Key

KKZCLIJZTNGZOX-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27190319

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.795

Distribution Coefficient, logD

4.792

Water Solubility, LogSw

-5.00

Polar Surface Area

72.091

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

F793-0211 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 F793-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F793-0211?
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What is the minimum amount of F793-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F793-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F793-0211
  • 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 F793-0211 available by request