3156-0204 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-propoxybenzamide

3156-0204 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-propoxybenzamide
3156-0204 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3156-0204
N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-propoxybenzamide

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

3156-0204

Molecular Formula

C23H19ClN2O2S (C23 H19 ClN2 O2 S)

Compound Name

N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-propoxybenzamide

IUPAC name

N-[3-(13-benzothiazol-2-yl)-4-chlorophenyl]-3-propoxybenzamide

SMILES

CCCOc1cccc(C(Nc(cc2)cc(-c3nc(cccc4)c4s3)c2Cl)=O)c1

InChI

InChI=1S/C23H19ClN2O2S/c1-2-12-28-17-7-5-6-15(13-17)22(27)25-16-10-11-19(24)18(14-16)23-26-20-8-3-4-9-21(20)29-23/h3-11,13-14H,2,12H2,1H3,(H,25,27)

InChI Key

VGGSCAPFRFBFAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02086396

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

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.834

Distribution Coefficient, logD

6.834

Water Solubility, LogSw

-6.35

Polar Surface Area

40.196

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

3156-0204 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3156-0204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3156-0204?
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What is the minimum amount of 3156-0204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3156-0204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3156-0204
  • 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 3156-0204 available by request