F793-0344 Screening compound: methyl 2-[(2-{5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]benzoate

F793-0344 Screening compound: methyl 2-[(2-{5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]benzoate
F793-0344 Screening compound: methyl 2-[(2-{5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F793-0344
methyl 2-[(2-{5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]benzoate

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

F793-0344

Molecular Formula

C22H20FN5O4S (C22 H20 FN5 O4 S)

Compound Name

methyl 2-[(2-{5-[(4-fluorophenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]benzoate

IUPAC name

methyl 2-[(2-{5-[(4-fluorophenyl)carbamoyl]-134-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]benzoate

SMILES

COC(c(cccc1)c1NC(N(CCC1)C1c1nnc(C(Nc(cc2)ccc2F)=O)s1)=O)=O

InChI

InChI=1S/C22H20FN5O4S/c1-32-21(30)15-5-2-3-6-16(15)25-22(31)28-12-4-7-17(28)19-26-27-20(33-19)18(29)24-14-10-8-13(23)9-11-14/h2-3,5-6,8-11,17H,4,7,12H2,1H3,(H,24,29)(H,25,31)/t17-/m0/s1

InChI Key

VLLYMLPJKZLATC-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27190338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.306

Distribution Coefficient, logD

3.304

Water Solubility, LogSw

-3.80

Polar Surface Area

92.567

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

F793-0344 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F793-0344 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F793-0344?
Check Price and Availability of F793-0344, 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 F793-0344 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F793-0344
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F793-0344
  • 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 F793-0344 available by request