C782-0529 Screening compound: 6-ethoxy-2-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-1,3-benzothiazole

C782-0529 Screening compound: 6-ethoxy-2-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-1,3-benzothiazole
C782-0529 Screening compound: 6-ethoxy-2-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C782-0529
6-ethoxy-2-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-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

C782-0529

Molecular Formula

C25H29FN4O2S (C25 H29 FN4 O2 S)

Compound Name

6-ethoxy-2-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-1,3-benzothiazole

IUPAC name

6-ethoxy-2-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-13-benzothiazole

SMILES

CCOc(cc1)cc2c1nc(N(CCC1)CC1C(N(CC1)CCN1c(cc1)ccc1F)=O)s2

InChI

InChI=1S/C25H29FN4O2S/c1-2-32-21-9-10-22-23(16-21)33-25(27-22)30-11-3-4-18(17-30)24(31)29-14-12-28(13-15-29)20-7-5-19(26)6-8-20/h5-10,16,18H,2-4,11-15,17H2,1H3/t18-/m0/s1

InChI Key

VGNXVRVWGKRTSD-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14794028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.6

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.909

Distribution Coefficient, logD

4.909

Water Solubility, LogSw

-4.72

Polar Surface Area

40.192

Acid Dissociation Constant (pKa)

22.82

Base Dissociation Constant (pKb)

3.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with C782-0529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C782-0529?
Check Price and Availability of C782-0529, 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 C782-0529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C782-0529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C782-0529
  • 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 C782-0529 available by request