C356-0134 Screening compound: (6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-methanesulfonyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

C356-0134 Screening compound: (6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-methanesulfonyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
C356-0134 Screening compound: (6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-methanesulfonyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C356-0134
(6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-methanesulfonyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

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

C356-0134

Molecular Formula

C23H18ClN5O4S2 (C23 H18 ClN5 O4 S2)

Compound Name

(6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-methanesulfonyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

IUPAC name

(6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-methanesulfonyl-5H6H7H-[134]thiadiazolo[32-a]pyrimidin-7-one

SMILES

CS(C(SC1=NC(/C2=C/c3cn(CCOc(cccc4)c4Cl)c4c3cccc4)=O)=NN1C2=N)(=O)=O

InChI

InChI=1S/C23H18ClN5O4S2/c1-35(31,32)23-27-29-20(25)16(21(30)26-22(29)34-23)12-14-13-28(18-8-4-2-6-15(14)18)10-11-33-19-9-5-3-7-17(19)24/h2-9,12-13,25H,10-11H2,1H3

InChI Key

WTTLBWMONMYGAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14751868

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.01

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.986

Distribution Coefficient, logD

2.891

Water Solubility, LogSw

-3.45

Polar Surface Area

93.766

Acid Dissociation Constant (pKa)

24.37

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with C356-0134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C356-0134?
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What is the minimum amount of C356-0134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C356-0134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C356-0134
  • 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 C356-0134 available by request