2810-0587 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-chloro-4-ethoxybenzamide

2810-0587 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-chloro-4-ethoxybenzamide
2810-0587 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-chloro-4-ethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2810-0587
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-chloro-4-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

2810-0587

Molecular Formula

C23H19ClN2O2S (C23 H19 ClN2 O2 S)

Compound Name

N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-chloro-4-ethoxybenzamide

IUPAC name

N-[3-(13-benzothiazol-2-yl)-2-methylphenyl]-3-chloro-4-ethoxybenzamide

SMILES

CCOc(ccc(C(Nc1c(C)c(-c2nc(cccc3)c3s2)ccc1)=O)c1)c1Cl

InChI

InChI=1S/C23H19ClN2O2S/c1-3-28-20-12-11-15(13-17(20)24)22(27)25-18-9-6-7-16(14(18)2)23-26-19-8-4-5-10-21(19)29-23/h4-13H,3H2,1-2H3,(H,25,27)

InChI Key

DTQPKCGFAOPLNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02084802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.93

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

5.998

Distribution Coefficient, logD

5.998

Water Solubility, LogSw

-5.95

Polar Surface Area

39.291

Acid Dissociation Constant (pKa)

10.88

Base Dissociation Constant (pKb)

-0.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

2810-0587 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2810-0587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2810-0587?
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What is the minimum amount of 2810-0587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2810-0587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2810-0587
  • 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 2810-0587 available by request