F793-0461 Screening compound: ethyl 2-[(2-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]acetate

F793-0461 Screening compound: ethyl 2-[(2-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]acetate
F793-0461 Screening compound: ethyl 2-[(2-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F793-0461
ethyl 2-[(2-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]acetate

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

F793-0461

Molecular Formula

C19H23N5O4S (C19 H23 N5 O4 S)

Compound Name

ethyl 2-[(2-{5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]acetate

IUPAC name

ethyl 2-[(2-{5-[(4-methylphenyl)carbamoyl]-134-thiadiazol-2-yl}pyrrolidine-1-carbonyl)amino]acetate

SMILES

CCOC(CNC(N(CCC1)C1c1nnc(C(Nc2ccc(C)cc2)=O)s1)=O)=O

InChI

InChI=1S/C19H23N5O4S/c1-3-28-15(25)11-20-19(27)24-10-4-5-14(24)17-22-23-18(29-17)16(26)21-13-8-6-12(2)7-9-13/h6-9,14H,3-5,10-11H2,1-2H3,(H,20,27)(H,21,26)/t14-/m0/s1

InChI Key

YEZAQRTZTVJUOZ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27190392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.164

Distribution Coefficient, logD

2.164

Water Solubility, LogSw

-2.73

Polar Surface Area

93.844

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

F793-0461 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 F793-0461 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F793-0461?
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What is the minimum amount of F793-0461 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F793-0461
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F793-0461
  • 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 F793-0461 available by request