4903-2246 Screening compound: 4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine

4903-2246 Screening compound: 4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine
4903-2246 Screening compound: 4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4903-2246
4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine

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

4903-2246

Molecular Formula

C26H23F3N4O3S (C26 H23 F3 N4 O3 S)

Compound Name

4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine

IUPAC name

4-[4-methyl-3-(morpholine-4-sulfonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine

SMILES

Cc(ccc(-c(c1ccccc11)nnc1Nc1cc(C(F)(F)F)ccc1)c1)c1S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C26H23F3N4O3S/c1-17-9-10-18(15-23(17)37(34,35)33-11-13-36-14-12-33)24-21-7-2-3-8-22(21)25(32-31-24)30-20-6-4-5-19(16-20)26(27,28)29/h2-10,15-16H,11-14H2,1H3,(H,30,32)

InChI Key

FSHRFDYITIEENB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03305331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.528

Distribution Coefficient, logD

5.527

Water Solubility, LogSw

-5.90

Polar Surface Area

71.380

Acid Dissociation Constant (pKa)

17.80

Base Dissociation Constant (pKb)

4.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

4903-2246 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

CNS targets activity set (6557 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 4903-2246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4903-2246?
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What is the minimum amount of 4903-2246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4903-2246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4903-2246
  • 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 4903-2246 available by request