D408-0579 Screening compound: 3-(6-methoxy-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)urea

D408-0579 Screening compound: 3-(6-methoxy-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)urea
D408-0579 Screening compound: 3-(6-methoxy-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D408-0579
3-(6-methoxy-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)urea

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

D408-0579

Molecular Formula

C16H15N3O3S (C16 H15 N3 O3 S)

Compound Name

3-(6-methoxy-1,3-benzothiazol-2-yl)-1-(2-methoxyphenyl)urea

IUPAC name

3-(6-methoxy-13-benzothiazol-2-yl)-1-(2-methoxyphenyl)urea

SMILES

COc(cc1)cc2c1nc(NC(Nc(cccc1)c1OC)=O)s2

InChI

InChI=1S/C16H15N3O3S/c1-21-10-7-8-12-14(9-10)23-16(18-12)19-15(20)17-11-5-3-4-6-13(11)22-2/h3-9H,1-2H3,(H2,17,18,19,20)

InChI Key

PUCRNHFWTVNVPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07696123

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.188

Distribution Coefficient, logD

4.188

Water Solubility, LogSw

-4.43

Polar Surface Area

56.779

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D408-0579 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D408-0579 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D408-0579?
Check Price and Availability of D408-0579, 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 D408-0579 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D408-0579
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D408-0579
  • 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 D408-0579 available by request