F792-1472 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-cyclopentylpropanoyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide

F792-1472 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-cyclopentylpropanoyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide
F792-1472 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-cyclopentylpropanoyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F792-1472
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-cyclopentylpropanoyl)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

F792-1472

Molecular Formula

C22H26N4O4S (C22 H26 N4 O4 S)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-cyclopentylpropanoyl)pyrrolidin-2-yl]-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-5-[1-(3-cyclopentylpropanoyl)pyrrolidin-2-yl]-134-thiadiazole-2-carboxamide

SMILES

O=C(CCC1CCCC1)N(CCC1)C1c1nnc(C(Nc(cc2)cc3c2OCO3)=O)s1

InChI

InChI=1S/C22H26N4O4S/c27-19(10-7-14-4-1-2-5-14)26-11-3-6-16(26)21-24-25-22(31-21)20(28)23-15-8-9-17-18(12-15)30-13-29-17/h8-9,12,14,16H,1-7,10-11,13H2,(H,23,28)/t16-/m0/s1

InChI Key

WHZWOTNWTPZWIQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27190201

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.356

Distribution Coefficient, logD

3.355

Water Solubility, LogSw

-3.66

Polar Surface Area

80.417

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

-0.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

F792-1472 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F792-1472 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F792-1472?
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What is the minimum amount of F792-1472 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F792-1472
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F792-1472
  • 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 F792-1472 available by request