F736-0974 Screening compound: 5-[({[(2,3-dimethoxyphenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

F736-0974 Screening compound: 5-[({[(2,3-dimethoxyphenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
F736-0974 Screening compound: 5-[({[(2,3-dimethoxyphenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F736-0974
5-[({[(2,3-dimethoxyphenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-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

F736-0974

Molecular Formula

C21H22N4O4S2 (C21 H22 N4 O4 S2)

Compound Name

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

IUPAC name

5-[({[(23-dimethoxyphenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-134-thiadiazole-2-carboxamide

SMILES

Cc(cc1)ccc1NC(c1nnc(SCC(NCc(cccc2OC)c2OC)=O)s1)=O

InChI

InChI=1S/C21H22N4O4S2/c1-13-7-9-15(10-8-13)23-19(27)20-24-25-21(31-20)30-12-17(26)22-11-14-5-4-6-16(28-2)18(14)29-3/h4-10H,11-12H2,1-3H3,(H,22,26)(H,23,27)

InChI Key

GPRADSDHRKPLPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14965605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.719

Distribution Coefficient, logD

3.719

Water Solubility, LogSw

-3.97

Polar Surface Area

85.742

Acid Dissociation Constant (pKa)

11.81

Base Dissociation Constant (pKb)

-0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with F736-0974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F736-0974?
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What is the minimum amount of F736-0974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F736-0974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F736-0974
  • 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 F736-0974 available by request