C301-9354 Screening compound: N-{3-[(4-fluorophenyl)methanesulfonyl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide

C301-9354 Screening compound: N-{3-[(4-fluorophenyl)methanesulfonyl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide
C301-9354 Screening compound: N-{3-[(4-fluorophenyl)methanesulfonyl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-9354
N-{3-[(4-fluorophenyl)methanesulfonyl]-1,2,4-thiadiazol-5-yl}thiophene-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

C301-9354

Molecular Formula

C14H10FN3O3S3 (C14 H10 FN3 O3 S3)

Compound Name

N-{3-[(4-fluorophenyl)methanesulfonyl]-1,2,4-thiadiazol-5-yl}thiophene-2-carboxamide

IUPAC name

N-{3-[(4-fluorophenyl)methanesulfonyl]-124-thiadiazol-5-yl}thiophene-2-carboxamide

SMILES

O=C(c1cccs1)Nc1nc(S(Cc(cc2)ccc2F)(=O)=O)ns1

InChI

InChI=1S/C14H10FN3O3S3/c15-10-5-3-9(4-6-10)8-24(20,21)14-17-13(23-18-14)16-12(19)11-2-1-7-22-11/h1-7H,8H2,(H,16,17,18,19)

InChI Key

IFQABMVAQMCISA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14745913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.945

Distribution Coefficient, logD

2.557

Water Solubility, LogSw

-3.45

Polar Surface Area

73.522

Acid Dissociation Constant (pKa)

7.24

Base Dissociation Constant (pKb)

-7.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

C301-9354 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 C301-9354 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-9354?
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What is the minimum amount of C301-9354 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-9354
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-9354
  • 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 C301-9354 available by request