F727-0756 Screening compound: 3,5-dimethyl-4-isoxazolyl {4-[6-(3-methoxyphenyl)-4-pyrimidinyl]piperazino} sulfone

F727-0756 Screening compound: 3,5-dimethyl-4-isoxazolyl {4-[6-(3-methoxyphenyl)-4-pyrimidinyl]piperazino} sulfone
F727-0756 Screening compound: 3,5-dimethyl-4-isoxazolyl {4-[6-(3-methoxyphenyl)-4-pyrimidinyl]piperazino} sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound F727-0756
3,5-dimethyl-4-isoxazolyl {4-[6-(3-methoxyphenyl)-4-pyrimidinyl]piperazino} sulfone

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

F727-0756

Molecular Formula

C20H23N5O4S (C20 H23 N5 O4 S)

Compound Name

3,5-dimethyl-4-isoxazolyl {4-[6-(3-methoxyphenyl)-4-pyrimidinyl]piperazino} sulfone

IUPAC name

n/a

SMILES

Cc1noc(C)c1S(N(CC1)CCN1c1ncnc(-c2cc(OC)ccc2)c1)(=O)=O

InChI

InChI=1S/C20H23N5O4S/c1-14-20(15(2)29-23-14)30(26,27)25-9-7-24(8-10-25)19-12-18(21-13-22-19)16-5-4-6-17(11-16)28-3/h4-6,11-13H,7-10H2,1-3H3

InChI Key

RPCKKFLJPZSHTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27188604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.923

Distribution Coefficient, logD

2.843

Water Solubility, LogSw

-3.34

Polar Surface Area

83.794

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

6.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

F727-0756 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F727-0756 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F727-0756?
Check Price and Availability of F727-0756, 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 F727-0756 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F727-0756
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F727-0756
  • 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 F727-0756 available by request