G952-0616 Screening compound: N-[3-(4-ethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide

G952-0616 Screening compound: N-[3-(4-ethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide
G952-0616 Screening compound: N-[3-(4-ethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G952-0616
N-[3-(4-ethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide

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

G952-0616

Molecular Formula

C18H21N5O2S (C18 H21 N5 O2 S)

Compound Name

N-[3-(4-ethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide

IUPAC name

N-[3-(4-ethoxyphenyl)-[124]triazolo[34-b][134]thiadiazol-6-yl]cyclohexanecarboxamide

SMILES

CCOc(cc1)ccc1-c1nnc2sc(NC(C3CCCCC3)=O)nn12

InChI

InChI=1S/C18H21N5O2S/c1-2-25-14-10-8-12(9-11-14)15-20-21-18-23(15)22-17(26-18)19-16(24)13-6-4-3-5-7-13/h8-11,13H,2-7H2,1H3,(H,19,22,24)

InChI Key

BIMRETBOCRGRPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27170177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.854

Distribution Coefficient, logD

3.850

Water Solubility, LogSw

-3.79

Polar Surface Area

64.441

Acid Dissociation Constant (pKa)

9.44

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with G952-0616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G952-0616?
Check Price and Availability of G952-0616, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G952-0616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G952-0616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G952-0616
  • 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 G952-0616 available by request