D153-0049 Screening compound: 2-{4-[4-(trifluoromethoxy)benzenesulfonyl]piperazin-1-yl}-1,3-benzothiazole

D153-0049 Screening compound: 2-{4-[4-(trifluoromethoxy)benzenesulfonyl]piperazin-1-yl}-1,3-benzothiazole
D153-0049 Screening compound: 2-{4-[4-(trifluoromethoxy)benzenesulfonyl]piperazin-1-yl}-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D153-0049
2-{4-[4-(trifluoromethoxy)benzenesulfonyl]piperazin-1-yl}-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

D153-0049

Molecular Formula

C18H16F3N3O3S2 (C18 H16 F3 N3 O3 S2)

Compound Name

2-{4-[4-(trifluoromethoxy)benzenesulfonyl]piperazin-1-yl}-1,3-benzothiazole

IUPAC name

2-{4-[4-(trifluoromethoxy)benzenesulfonyl]piperazin-1-yl}-13-benzothiazole

SMILES

O=S(c(cc1)ccc1OC(F)(F)F)(N(CC1)CCN1c1nc(cccc2)c2s1)=O

InChI

InChI=1S/C18H16F3N3O3S2/c19-18(20,21)27-13-5-7-14(8-6-13)29(25,26)24-11-9-23(10-12-24)17-22-15-3-1-2-4-16(15)28-17/h1-8H,9-12H2

InChI Key

LSWPNGDWFOUYEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06634908

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.087

Distribution Coefficient, logD

5.087

Water Solubility, LogSw

-5.19

Polar Surface Area

50.682

Acid Dissociation Constant (pKa)

23.49

Base Dissociation Constant (pKb)

2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with D153-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D153-0049?
Check Price and Availability of D153-0049, 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 D153-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D153-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D153-0049
  • 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 D153-0049 available by request