C200-9112 Screening compound: (3-fluorophenyl){4-[5-(4-methoxyphenyl)-2-thienyl]piperazino}methanone

C200-9112 Screening compound: (3-fluorophenyl){4-[5-(4-methoxyphenyl)-2-thienyl]piperazino}methanone
C200-9112 Screening compound: (3-fluorophenyl){4-[5-(4-methoxyphenyl)-2-thienyl]piperazino}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-9112
(3-fluorophenyl){4-[5-(4-methoxyphenyl)-2-thienyl]piperazino}methanone

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

C200-9112

Molecular Formula

C22H21FN2O2S (C22 H21 FN2 O2 S)

Compound Name

(3-fluorophenyl){4-[5-(4-methoxyphenyl)-2-thienyl]piperazino}methanone

IUPAC name

n/a

SMILES

COc(cc1)ccc1-c1ccc(N(CC2)CCN2C(c2cc(F)ccc2)=O)s1

InChI

InChI=1S/C22H21FN2O2S/c1-27-19-7-5-16(6-8-19)20-9-10-21(28-20)24-11-13-25(14-12-24)22(26)17-3-2-4-18(23)15-17/h2-10,15H,11-14H2,1H3

InChI Key

SQLRNECURFDUEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729003

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.761

Distribution Coefficient, logD

4.761

Water Solubility, LogSw

-4.63

Polar Surface Area

28.789

Acid Dissociation Constant (pKa)

27.19

Base Dissociation Constant (pKb)

-4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

C200-9112 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C200-9112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-9112?
Check Price and Availability of C200-9112, 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 C200-9112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-9112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-9112
  • 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 C200-9112 available by request