C760-1134 Screening compound: 1-{4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

C760-1134 Screening compound: 1-{4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine
C760-1134 Screening compound: 1-{4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-1134
1-{4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

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

C760-1134

Molecular Formula

C21H23F3N2OS (C21 H23 F3 N2 OS)

Compound Name

1-{4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

IUPAC name

1-{4H5H6H7H8H-cyclohepta[b]thiophene-3-carbonyl}-4-[3-(trifluoromethyl)phenyl]piperazine

SMILES

O=C(c1csc2c1CCCCC2)N(CC1)CCN1c1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C21H23F3N2OS/c22-21(23,24)15-5-4-6-16(13-15)25-9-11-26(12-10-25)20(27)18-14-28-19-8-3-1-2-7-17(18)19/h4-6,13-14H,1-3,7-12H2

InChI Key

QPXSMRUYSGEWCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792086

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.49

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.184

Distribution Coefficient, logD

5.184

Water Solubility, LogSw

-5.32

Polar Surface Area

21.417

Acid Dissociation Constant (pKa)

25.20

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

References: we are preparing a list of scientific research reports with C760-1134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-1134?
Check Price and Availability of C760-1134, 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 C760-1134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-1134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-1134
  • 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 C760-1134 available by request