6712-1049 Screening compound: 3,4-dimethoxy-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide

6712-1049 Screening compound: 3,4-dimethoxy-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide
6712-1049 Screening compound: 3,4-dimethoxy-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6712-1049
3,4-dimethoxy-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-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

6712-1049

Molecular Formula

C21H20N2O4S (C21 H20 N2 O4 S)

Compound Name

3,4-dimethoxy-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide

IUPAC name

34-dimethoxy-N-{8-methoxy-4H5H-naphtho[12-d][13]thiazol-2-yl}benzamide

SMILES

COc1cc(-c2c(CC3)sc(NC(c(cc4)cc(OC)c4OC)=O)n2)c3cc1

InChI

InChI=1S/C21H20N2O4S/c1-25-14-7-4-12-6-9-18-19(15(12)11-14)22-21(28-18)23-20(24)13-5-8-16(26-2)17(10-13)27-3/h4-5,7-8,10-11H,6,9H2,1-3H3,(H,22,23,24)

InChI Key

UGRFCHFUIFHXJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05237616

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.560

Distribution Coefficient, logD

4.560

Water Solubility, LogSw

-4.42

Polar Surface Area

56.691

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

6712-1049 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-infective Library (19449 compounds)

SmartTM Library (51161 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Anti-HIV1 Library (19540 compounds)

Epigenetics Focused Set (26518 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 6712-1049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6712-1049?
Check Price and Availability of 6712-1049, 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 6712-1049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6712-1049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6712-1049
  • 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 6712-1049 available by request