F736-0658 Screening compound: N-(4-fluorophenyl)-5-({[(1-phenylethyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide

F736-0658 Screening compound: N-(4-fluorophenyl)-5-({[(1-phenylethyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide
F736-0658 Screening compound: N-(4-fluorophenyl)-5-({[(1-phenylethyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F736-0658
N-(4-fluorophenyl)-5-({[(1-phenylethyl)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

F736-0658

Molecular Formula

C19H17FN4O2S2 (C19 H17 FN4 O2 S2)

Compound Name

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

IUPAC name

N-(4-fluorophenyl)-5-({[(1-phenylethyl)carbamoyl]methyl}sulfanyl)-134-thiadiazole-2-carboxamide

SMILES

CC(c1ccccc1)NC(CSc1nnc(C(Nc(cc2)ccc2F)=O)s1)=O

InChI

InChI=1S/C19H17FN4O2S2/c1-12(13-5-3-2-4-6-13)21-16(25)11-27-19-24-23-18(28-19)17(26)22-15-9-7-14(20)8-10-15/h2-10,12H,11H2,1H3,(H,21,25)(H,22,26)/t12-/m0/s1

InChI Key

QDDYKCKCVAAICJ-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD14965510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.411

Distribution Coefficient, logD

3.410

Water Solubility, LogSw

-3.81

Polar Surface Area

69.558

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with F736-0658 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F736-0658?
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What is the minimum amount of F736-0658 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F736-0658
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F736-0658
  • 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 F736-0658 available by request