8019-3731 Screening compound: 3-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]-1,2-benzothiazole

8019-3731 Screening compound: 3-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]-1,2-benzothiazole
8019-3731 Screening compound: 3-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]-1,2-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3731
3-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]-1,2-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

8019-3731

Molecular Formula

C21H23N3O4S (C21 H23 N3 O4 S)

Compound Name

3-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]-1,2-benzothiazole

IUPAC name

3-[4-(345-trimethoxybenzoyl)piperazin-1-yl]-12-benzothiazole

SMILES

COc1cc(C(N(CC2)CCN2c2nsc3c2cccc3)=O)cc(OC)c1OC

InChI

InChI=1S/C21H23N3O4S/c1-26-16-12-14(13-17(27-2)19(16)28-3)21(25)24-10-8-23(9-11-24)20-15-6-4-5-7-18(15)29-22-20/h4-7,12-13H,8-11H2,1-3H3

InChI Key

KVYDRHVCRZJMDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09064574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.434

Distribution Coefficient, logD

3.434

Water Solubility, LogSw

-3.79

Polar Surface Area

53.278

Acid Dissociation Constant (pKa)

24.32

Base Dissociation Constant (pKb)

7.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 8019-3731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3731?
Check Price and Availability of 8019-3731, 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 8019-3731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3731
  • 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 8019-3731 available by request