6773-0151 Screening compound: N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-4,6-bis(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide

6773-0151 Screening compound: N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-4,6-bis(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide
6773-0151 Screening compound: N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-4,6-bis(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6773-0151
N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-4,6-bis(thiophen-2-yl)pyridin-2-yl]sulfanyl}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

6773-0151

Molecular Formula

C23H14N4OS4 (C23 H14 N4 OS4)

Compound Name

N-(1,3-benzothiazol-2-yl)-2-{[3-cyano-4,6-bis(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide

IUPAC name

N-(13-benzothiazol-2-yl)-2-{[3-cyano-46-bis(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetamide

SMILES

N#Cc(c(SCC(Nc1nc(cccc2)c2s1)=O)nc(-c1cccs1)c1)c1-c1cccs1

InChI

InChI=1S/C23H14N4OS4/c24-12-15-14(18-7-3-9-29-18)11-17(19-8-4-10-30-19)25-22(15)31-13-21(28)27-23-26-16-5-1-2-6-20(16)32-23/h1-11H,13H2,(H,26,27,28)

InChI Key

LXSXWEAXVFHTAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01242806

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.65

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.832

Distribution Coefficient, logD

6.832

Water Solubility, LogSw

-6.06

Polar Surface Area

60.175

Acid Dissociation Constant (pKa)

11.35

Base Dissociation Constant (pKb)

2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

6773-0151 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6773-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6773-0151?
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What is the minimum amount of 6773-0151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6773-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6773-0151
  • 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 6773-0151 available by request