F938-0237 Screening compound: N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide

F938-0237 Screening compound: N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide
F938-0237 Screening compound: N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F938-0237
N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-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

F938-0237

Molecular Formula

C20H14Cl2N4O2S (C20 H14 Cl2 N4 O2 S)

Compound Name

N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide

IUPAC name

N-[2-({3-chloro-1-[(4-chlorophenyl)methyl]-1H-124-triazol-5-yl}sulfanyl)phenyl]furan-2-carboxamide

SMILES

O=C(c1ccco1)Nc(cccc1)c1Sc1nc(Cl)nn1Cc(cc1)ccc1Cl

InChI

InChI=1S/C20H14Cl2N4O2S/c21-14-9-7-13(8-10-14)12-26-20(24-19(22)25-26)29-17-6-2-1-4-15(17)23-18(27)16-5-3-11-28-16/h1-11H,12H2,(H,23,27)

InChI Key

WOLBAWPSGUCGSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14972847

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.922

Distribution Coefficient, logD

4.922

Water Solubility, LogSw

-5.09

Polar Surface Area

55.041

Acid Dissociation Constant (pKa)

13.16

Base Dissociation Constant (pKb)

-0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

F938-0237 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F938-0237 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F938-0237?
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What is the minimum amount of F938-0237 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F938-0237
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F938-0237
  • 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 F938-0237 available by request