3456-3797 Screening compound: 4-tert-butyl-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide

3456-3797 Screening compound: 4-tert-butyl-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide
3456-3797 Screening compound: 4-tert-butyl-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3456-3797
4-tert-butyl-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide

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

3456-3797

Molecular Formula

C19H20N2O2S (C19 H20 N2 O2 S)

Compound Name

4-tert-butyl-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide

IUPAC name

4-tert-butyl-N-(6-methoxy-13-benzothiazol-2-yl)benzamide

SMILES

CC(C)(C)c(cc1)ccc1C(Nc1nc(ccc(OC)c2)c2s1)=O

InChI

InChI=1S/C19H20N2O2S/c1-19(2,3)13-7-5-12(6-8-13)17(22)21-18-20-15-10-9-14(23-4)11-16(15)24-18/h5-11H,1-4H3,(H,20,21,22)

InChI Key

POYPJVRQQJAEAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01795970

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.741

Distribution Coefficient, logD

5.740

Water Solubility, LogSw

-5.50

Polar Surface Area

40.635

Acid Dissociation Constant (pKa)

10.02

Base Dissociation Constant (pKb)

0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

3456-3797 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-infective Library (19449 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases
  • Proteases
  • Ion Channels
  • Kinases

References: we are preparing a list of scientific research reports with 3456-3797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3456-3797?
Check Price and Availability of 3456-3797, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3456-3797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3456-3797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3456-3797
  • 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 3456-3797 available by request