6712-1040 Screening compound: 3-fluoro-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide

6712-1040 Screening compound: 3-fluoro-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide
6712-1040 Screening compound: 3-fluoro-N-{8-methoxy-4H,5H-naphtho[1,2-d][1,3]thiazol-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6712-1040
3-fluoro-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

6712-1040

Molecular Formula

C19H15FN2O2S (C19 H15 FN2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

COc1cc(-c2c(CC3)sc(NC(c4cc(F)ccc4)=O)n2)c3cc1

InChI

InChI=1S/C19H15FN2O2S/c1-24-14-7-5-11-6-8-16-17(15(11)10-14)21-19(25-16)22-18(23)12-3-2-4-13(20)9-12/h2-5,7,9-10H,6,8H2,1H3,(H,21,22,23)

InChI Key

KJLFBZRBYVNKQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05237602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.059

Distribution Coefficient, logD

5.049

Water Solubility, LogSw

-4.76

Polar Surface Area

41.430

Acid Dissociation Constant (pKa)

9.03

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

6712-1040 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 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
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 6712-1040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6712-1040?
Check Price and Availability of 6712-1040, 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 6712-1040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6712-1040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6712-1040
  • 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 6712-1040 available by request