F793-0392 Screening compound: N-(4-FLUOROPHENYL)-5-(1-{[(3-METHOXYBENZYL)AMINO]CARBONYL}-2-PYRROLIDINYL)-1,3,4-THIADIAZOLE-2-CARBOXAMIDE

F793-0392 Screening compound: N-(4-FLUOROPHENYL)-5-(1-{[(3-METHOXYBENZYL)AMINO]CARBONYL}-2-PYRROLIDINYL)-1,3,4-THIADIAZOLE-2-CARBOXAMIDE
F793-0392 Screening compound: N-(4-FLUOROPHENYL)-5-(1-{[(3-METHOXYBENZYL)AMINO]CARBONYL}-2-PYRROLIDINYL)-1,3,4-THIADIAZOLE-2-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound F793-0392
N-(4-FLUOROPHENYL)-5-(1-{[(3-METHOXYBENZYL)AMINO]CARBONYL}-2-PYRROLIDINYL)-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

F793-0392

Molecular Formula

C22H22FN5O3S (C22 H22 FN5 O3 S)

Compound Name

N-(4-FLUOROPHENYL)-5-(1-{[(3-METHOXYBENZYL)AMINO]CARBONYL}-2-PYRROLIDINYL)-1,3,4-THIADIAZOLE-2-CARBOXAMIDE

IUPAC name

n/a

SMILES

COc1cccc(CNC(N(CCC2)C2c2nnc(C(Nc(cc3)ccc3F)=O)s2)=O)c1

InChI

InChI=1S/C22H22FN5O3S/c1-31-17-5-2-4-14(12-17)13-24-22(30)28-11-3-6-18(28)20-26-27-21(32-20)19(29)25-16-9-7-15(23)8-10-16/h2,4-5,7-10,12,18H,3,6,11,13H2,1H3,(H,24,30)(H,25,29)/t18-/m0/s1

InChI Key

HQUXGHSSXOCNLV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27190354

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.045

Distribution Coefficient, logD

3.043

Water Solubility, LogSw

-3.54

Polar Surface Area

80.957

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-0.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

7.00

F793-0392 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

PD-1/L1 Library (498 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F793-0392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F793-0392?
Check Price and Availability of F793-0392, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F793-0392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F793-0392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F793-0392
  • 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 F793-0392 available by request