D341-1985 Screening compound: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethoxybenzamide

D341-1985 Screening compound: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethoxybenzamide
D341-1985 Screening compound: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D341-1985
N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethoxybenzamide

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

D341-1985

Molecular Formula

C22H18N2O2S (C22 H18 N2 O2 S)

Compound Name

N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethoxybenzamide

IUPAC name

N-[3-(13-benzothiazol-2-yl)phenyl]-2-ethoxybenzamide

SMILES

CCOc(cccc1)c1C(Nc1cccc(-c2nc(cccc3)c3s2)c1)=O

InChI

InChI=1S/C22H18N2O2S/c1-2-26-19-12-5-3-10-17(19)21(25)23-16-9-7-8-15(14-16)22-24-18-11-4-6-13-20(18)27-22/h3-14H,2H2,1H3,(H,23,25)

InChI Key

OHAPNYMLHXZSOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01145841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.606

Distribution Coefficient, logD

5.605

Water Solubility, LogSw

-5.43

Polar Surface Area

39.989

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

D341-1985 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D341-1985 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D341-1985?
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What is the minimum amount of D341-1985 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D341-1985
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D341-1985
  • 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 D341-1985 available by request