C187-0173 Screening compound: N-[(4-ethoxyphenyl)methyl]-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

C187-0173 Screening compound: N-[(4-ethoxyphenyl)methyl]-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide
C187-0173 Screening compound: N-[(4-ethoxyphenyl)methyl]-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C187-0173
N-[(4-ethoxyphenyl)methyl]-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-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

C187-0173

Molecular Formula

C18H18N2O3S (C18 H18 N2 O3 S)

Compound Name

N-[(4-ethoxyphenyl)methyl]-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

IUPAC name

N-[(4-ethoxyphenyl)methyl]-2-(2-oxo-23-dihydro-13-benzothiazol-3-yl)acetamide

SMILES

CCOc1ccc(CNC(CN(c(cccc2)c2S2)C2=O)=O)cc1

InChI

InChI=1S/C18H18N2O3S/c1-2-23-14-9-7-13(8-10-14)11-19-17(21)12-20-15-5-3-4-6-16(15)24-18(20)22/h3-10H,2,11-12H2,1H3,(H,19,21)

InChI Key

ZNFNUMDDBHXPEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14724568

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.045

Distribution Coefficient, logD

3.045

Water Solubility, LogSw

-3.39

Polar Surface Area

47.406

Acid Dissociation Constant (pKa)

14.27

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

C187-0173 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C187-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C187-0173?
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What is the minimum amount of C187-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C187-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C187-0173
  • 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 C187-0173 available by request