3011-0276 Screening compound: 4-(4-{2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonyl)morpholine

3011-0276 Screening compound: 4-(4-{2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonyl)morpholine
3011-0276 Screening compound: 4-(4-{2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonyl)morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3011-0276
4-(4-{2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonyl)morpholine

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

3011-0276

Molecular Formula

C28H24FN5O5S2 (C28 H24 FN5 O5 S2)

Compound Name

4-(4-{2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}benzenesulfonyl)morpholine

IUPAC name

4-(4-{2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-45-dihydro-1H-pyrazol-1-yl]-13-thiazol-4-yl}benzenesulfonyl)morpholine

SMILES

[O-][N+](c1cccc(C(CC2c(cc3)ccc3F)=NN2c2nc(-c(cc3)ccc3S(N3CCOCC3)(=O)=O)cs2)c1)=O

InChI

InChI=1S/C28H24FN5O5S2/c29-22-8-4-20(5-9-22)27-17-25(21-2-1-3-23(16-21)34(35)36)31-33(27)28-30-26(18-40-28)19-6-10-24(11-7-19)41(37,38)32-12-14-39-15-13-32/h1-11,16,18,27H,12-15,17H2/t27-/m0/s1

InChI Key

HRPMXCRUGMYSIL-MHZLTWQESA-N

MDL Number (MFCD)

MFCD00822860

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

593.66

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

6.351

Distribution Coefficient, logD

6.351

Water Solubility, LogSw

-6.40

Polar Surface Area

96.469

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

2.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.40

3011-0276 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 3011-0276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3011-0276?
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What is the minimum amount of 3011-0276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3011-0276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3011-0276
  • 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 3011-0276 available by request