F792-0604 Screening compound: 5-{1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-2-yl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

F792-0604 Screening compound: 5-{1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-2-yl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
F792-0604 Screening compound: 5-{1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-2-yl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F792-0604
5-{1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-2-yl}-N-(4-methylphenyl)-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

F792-0604

Molecular Formula

C22H21FN4O3S (C22 H21 FN4 O3 S)

Compound Name

5-{1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-2-yl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-{1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-2-yl}-N-(4-methylphenyl)-134-thiadiazole-2-carboxamide

SMILES

Cc(cc1)ccc1NC(c1nnc(C(CCC2)N2C(COc(cc2)ccc2F)=O)s1)=O

InChI

InChI=1S/C22H21FN4O3S/c1-14-4-8-16(9-5-14)24-20(29)22-26-25-21(31-22)18-3-2-12-27(18)19(28)13-30-17-10-6-15(23)7-11-17/h4-11,18H,2-3,12-13H2,1H3,(H,24,29)/t18-/m0/s1

InChI Key

HEBZMUBKPXZHSJ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27190150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.265

Distribution Coefficient, logD

3.265

Water Solubility, LogSw

-3.47

Polar Surface Area

70.242

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with F792-0604 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F792-0604?
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What is the minimum amount of F792-0604 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F792-0604
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F792-0604
  • 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 F792-0604 available by request