G856-9180 Screening compound: 2-(4-cyclohexanecarbonylpiperazin-1-yl)-4-methoxy-7-methyl-1,3-benzothiazole

G856-9180 Screening compound: 2-(4-cyclohexanecarbonylpiperazin-1-yl)-4-methoxy-7-methyl-1,3-benzothiazole
G856-9180 Screening compound: 2-(4-cyclohexanecarbonylpiperazin-1-yl)-4-methoxy-7-methyl-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-9180
2-(4-cyclohexanecarbonylpiperazin-1-yl)-4-methoxy-7-methyl-1,3-benzothiazole

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

G856-9180

Molecular Formula

C20H27N3O2S (C20 H27 N3 O2 S)

Compound Name

2-(4-cyclohexanecarbonylpiperazin-1-yl)-4-methoxy-7-methyl-1,3-benzothiazole

IUPAC name

2-(4-cyclohexanecarbonylpiperazin-1-yl)-4-methoxy-7-methyl-13-benzothiazole

SMILES

Cc(cc1)c2sc(N(CC3)CCN3C(C3CCCCC3)=O)nc2c1OC

InChI

InChI=1S/C20H27N3O2S/c1-14-8-9-16(25-2)17-18(14)26-20(21-17)23-12-10-22(11-13-23)19(24)15-6-4-3-5-7-15/h8-9,15H,3-7,10-13H2,1-2H3

InChI Key

LBAMUXKXUNVDPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07194080

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.711

Distribution Coefficient, logD

4.711

Water Solubility, LogSw

-4.36

Polar Surface Area

38.275

Acid Dissociation Constant (pKa)

23.34

Base Dissociation Constant (pKb)

9.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

G856-9180 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 G856-9180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-9180?
Check Price and Availability of G856-9180, 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 G856-9180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-9180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-9180
  • 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 G856-9180 available by request