F736-1013 Screening compound: N-(3-chlorophenyl)-5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide

F736-1013 Screening compound: N-(3-chlorophenyl)-5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide
F736-1013 Screening compound: N-(3-chlorophenyl)-5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F736-1013
N-(3-chlorophenyl)-5-({[(4-methoxyphenyl)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

F736-1013

Molecular Formula

C18H15ClN4O3S2 (C18 H15 ClN4 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)ccc1NC(CSc1nnc(C(Nc2cccc(Cl)c2)=O)s1)=O

InChI

InChI=1S/C18H15ClN4O3S2/c1-26-14-7-5-12(6-8-14)20-15(24)10-27-18-23-22-17(28-18)16(25)21-13-4-2-3-11(19)9-13/h2-9H,10H2,1H3,(H,20,24)(H,21,25)

InChI Key

GIEHQGCVIGXTOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14965618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.93

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.209

Distribution Coefficient, logD

4.208

Water Solubility, LogSw

-4.48

Polar Surface Area

76.616

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with F736-1013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F736-1013?
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What is the minimum amount of F736-1013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F736-1013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F736-1013
  • 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 F736-1013 available by request