F736-0653 Screening compound: N-(4-fluorophenyl)-5-({[(propan-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide

F736-0653 Screening compound: N-(4-fluorophenyl)-5-({[(propan-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide
F736-0653 Screening compound: N-(4-fluorophenyl)-5-({[(propan-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F736-0653
N-(4-fluorophenyl)-5-({[(propan-2-yl)carbamoyl]methyl}sulfanyl)-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

F736-0653

Molecular Formula

C14H15FN4O2S2 (C14 H15 FN4 O2 S2)

Compound Name

N-(4-fluorophenyl)-5-({[(propan-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

N-(4-fluorophenyl)-5-({[(propan-2-yl)carbamoyl]methyl}sulfanyl)-134-thiadiazole-2-carboxamide

SMILES

CC(C)NC(CSc1nnc(C(Nc(cc2)ccc2F)=O)s1)=O

InChI

InChI=1S/C14H15FN4O2S2/c1-8(2)16-11(20)7-22-14-19-18-13(23-14)12(21)17-10-5-3-9(15)4-6-10/h3-6,8H,7H2,1-2H3,(H,16,20)(H,17,21)

InChI Key

MJBLJZTUKOYOPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14965508

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.262

Distribution Coefficient, logD

2.261

Water Solubility, LogSw

-2.86

Polar Surface Area

69.640

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

5.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with F736-0653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F736-0653?
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What is the minimum amount of F736-0653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F736-0653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F736-0653
  • 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 F736-0653 available by request