F736-0983 Screening compound: 5-[({[(3-bromophenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide

F736-0983 Screening compound: 5-[({[(3-bromophenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
F736-0983 Screening compound: 5-[({[(3-bromophenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F736-0983
5-[({[(3-bromophenyl)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

F736-0983

Molecular Formula

C19H17BrN4O2S2 (C19 H17 BrN4 O2 S2)

Compound Name

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

IUPAC name

5-[({[(3-bromophenyl)methyl]carbamoyl}methyl)sulfanyl]-N-(4-methylphenyl)-134-thiadiazole-2-carboxamide

SMILES

Cc(cc1)ccc1NC(c1nnc(SCC(NCc2cccc(Br)c2)=O)s1)=O

InChI

InChI=1S/C19H17BrN4O2S2/c1-12-5-7-15(8-6-12)22-17(26)18-23-24-19(28-18)27-11-16(25)21-10-13-3-2-4-14(20)9-13/h2-9H,10-11H2,1H3,(H,21,25)(H,22,26)

InChI Key

FCMCIVSELRGNMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14965611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.41

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

4.331

Distribution Coefficient, logD

4.331

Water Solubility, LogSw

-4.30

Polar Surface Area

70.395

Acid Dissociation Constant (pKa)

11.81

Base Dissociation Constant (pKb)

-0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with F736-0983 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F736-0983?
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What is the minimum amount of F736-0983 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F736-0983
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F736-0983
  • 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 F736-0983 available by request