F792-0451 Screening compound: N-(4-fluorophenyl)-5-[1-(2-methoxyacetyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide

F792-0451 Screening compound: N-(4-fluorophenyl)-5-[1-(2-methoxyacetyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide
F792-0451 Screening compound: N-(4-fluorophenyl)-5-[1-(2-methoxyacetyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F792-0451
N-(4-fluorophenyl)-5-[1-(2-methoxyacetyl)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

F792-0451

Molecular Formula

C16H17FN4O3S (C16 H17 FN4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C16H17FN4O3S/c1-24-9-13(22)21-8-2-3-12(21)15-19-20-16(25-15)14(23)18-11-6-4-10(17)5-7-11/h4-7,12H,2-3,8-9H2,1H3,(H,18,23)/t12-/m0/s1

InChI Key

AJFZBDQVCSRWQO-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27190094

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.226

Distribution Coefficient, logD

1.223

Water Solubility, LogSw

-2.24

Polar Surface Area

71.438

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

F792-0451 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • 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 F792-0451 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F792-0451?
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What is the minimum amount of F792-0451 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F792-0451
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F792-0451
  • 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 F792-0451 available by request