L063-0727 Screening compound: 5-[(3-chloro-4-fluorobenzenesulfonamido)methyl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide

L063-0727 Screening compound: 5-[(3-chloro-4-fluorobenzenesulfonamido)methyl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
L063-0727 Screening compound: 5-[(3-chloro-4-fluorobenzenesulfonamido)methyl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L063-0727
5-[(3-chloro-4-fluorobenzenesulfonamido)methyl]-N-(2,4-difluorophenyl)-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

L063-0727

Molecular Formula

C16H10ClF3N4O3S2 (C16 H10 ClF3 N4 O3 S2)

Compound Name

5-[(3-chloro-4-fluorobenzenesulfonamido)methyl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-[(3-chloro-4-fluorobenzenesulfonamido)methyl]-N-(24-difluorophenyl)-134-thiadiazole-2-carboxamide

SMILES

O=C(c1nnc(CNS(c(cc2)cc(Cl)c2F)(=O)=O)s1)Nc(ccc(F)c1)c1F

InChI

InChI=1S/C16H10ClF3N4O3S2/c17-10-6-9(2-3-11(10)19)29(26,27)21-7-14-23-24-16(28-14)15(25)22-13-4-1-8(18)5-12(13)20/h1-6,21H,7H2,(H,22,25)

InChI Key

GDEMANURFHAPSK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27228343

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.86

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.217

Distribution Coefficient, logD

2.991

Water Solubility, LogSw

-3.58

Polar Surface Area

88.389

Acid Dissociation Constant (pKa)

7.57

Base Dissociation Constant (pKb)

-3.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

L063-0727 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with L063-0727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L063-0727?
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What is the minimum amount of L063-0727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L063-0727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L063-0727
  • 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 L063-0727 available by request