7489-2086 Screening compound: 2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

7489-2086 Screening compound: 2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
7489-2086 Screening compound: 2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7489-2086
2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

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

7489-2086

Molecular Formula

C14H14N4O2S2 (C14 H14 N4 O2 S2)

Compound Name

2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

2-(2-oxo-23-dihydro-13-benzothiazol-3-yl)-N-[5-(propan-2-yl)-134-thiadiazol-2-yl]acetamide

SMILES

CC(C)c1nnc(NC(CN(c(cccc2)c2S2)C2=O)=O)s1

InChI

InChI=1S/C14H14N4O2S2/c1-8(2)12-16-17-13(22-12)15-11(19)7-18-9-5-3-4-6-10(9)21-14(18)20/h3-6,8H,7H2,1-2H3,(H,15,17,19)

InChI Key

HSNUGESDEKWNQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06759439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.077

Distribution Coefficient, logD

3.030

Water Solubility, LogSw

-3.38

Polar Surface Area

62.506

Acid Dissociation Constant (pKa)

8.34

Base Dissociation Constant (pKb)

-1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 7489-2086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7489-2086?
Check Price and Availability of 7489-2086, 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 7489-2086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7489-2086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7489-2086
  • 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 7489-2086 available by request