G897-0165 Screening compound: N-[4-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-fluorobenzamide

G897-0165 Screening compound: N-[4-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-fluorobenzamide
G897-0165 Screening compound: N-[4-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G897-0165
N-[4-(1,3-benzothiazol-2-yl)-2-chlorophenyl]-2-fluorobenzamide

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

G897-0165

Molecular Formula

C20H12ClFN2OS (C20 H12 ClFN2 OS)

Compound Name

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

IUPAC name

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

SMILES

O=C(c(cccc1)c1F)Nc(ccc(-c1nc(cccc2)c2s1)c1)c1Cl

InChI

InChI=1S/C20H12ClFN2OS/c21-14-11-12(20-24-17-7-3-4-8-18(17)26-20)9-10-16(14)23-19(25)13-5-1-2-6-15(13)22/h1-11H,(H,23,25)

InChI Key

XCZVXCPENCCRRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074261

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.85

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.563

Distribution Coefficient, logD

5.546

Water Solubility, LogSw

-5.89

Polar Surface Area

32.081

Acid Dissociation Constant (pKa)

8.82

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

G897-0165 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G897-0165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G897-0165?
Check Price and Availability of G897-0165, 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 G897-0165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G897-0165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G897-0165
  • 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 G897-0165 available by request