F792-0440 Screening compound: 5-[1-(2-ethylbutanoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide

F792-0440 Screening compound: 5-[1-(2-ethylbutanoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
F792-0440 Screening compound: 5-[1-(2-ethylbutanoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F792-0440
5-[1-(2-ethylbutanoyl)pyrrolidin-2-yl]-N-(4-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

F792-0440

Molecular Formula

C19H23FN4O2S (C19 H23 FN4 O2 S)

Compound Name

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

IUPAC name

5-[1-(2-ethylbutanoyl)pyrrolidin-2-yl]-N-(4-fluorophenyl)-134-thiadiazole-2-carboxamide

SMILES

CCC(CC)C(N(CCC1)C1c1nnc(C(Nc(cc2)ccc2F)=O)s1)=O

InChI

InChI=1S/C19H23FN4O2S/c1-3-12(4-2)19(26)24-11-5-6-15(24)17-22-23-18(27-17)16(25)21-14-9-7-13(20)8-10-14/h7-10,12,15H,3-6,11H2,1-2H3,(H,21,25)/t15-/m0/s1

InChI Key

VLECLKFKGYUVNZ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27190084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.362

Distribution Coefficient, logD

3.359

Water Solubility, LogSw

-3.44

Polar Surface Area

63.542

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.40

F792-0440 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with F792-0440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F792-0440?
Check Price and Availability of F792-0440, 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 F792-0440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F792-0440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F792-0440
  • 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 F792-0440 available by request