F976-0154 Screening compound: 2-(4-fluorophenyl)-6-[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepan-1-yl]-2,3-dihydropyridazin-3-one

F976-0154 Screening compound: 2-(4-fluorophenyl)-6-[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepan-1-yl]-2,3-dihydropyridazin-3-one
F976-0154 Screening compound: 2-(4-fluorophenyl)-6-[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepan-1-yl]-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F976-0154
2-(4-fluorophenyl)-6-[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepan-1-yl]-2,3-dihydropyridazin-3-one

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

F976-0154

Molecular Formula

C25H27FN4O3S (C25 H27 FN4 O3 S)

Compound Name

2-(4-fluorophenyl)-6-[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepan-1-yl]-2,3-dihydropyridazin-3-one

IUPAC name

2-(4-fluorophenyl)-6-[4-(5678-tetrahydronaphthalene-2-sulfonyl)-14-diazepan-1-yl]-23-dihydropyridazin-3-one

SMILES

O=C(C=C1)N(c(cc2)ccc2F)N=C1N(CCC1)CCN1S(c1cc(CCCC2)c2cc1)(=O)=O

InChI

InChI=1S/C25H27FN4O3S/c26-21-7-9-22(10-8-21)30-25(31)13-12-24(27-30)28-14-3-15-29(17-16-28)34(32,33)23-11-6-19-4-1-2-5-20(19)18-23/h6-13,18H,1-5,14-17H2

InChI Key

LGRGZJXEUCMARW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973566

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.142

Distribution Coefficient, logD

4.142

Water Solubility, LogSw

-4.25

Polar Surface Area

62.475

Acid Dissociation Constant (pKa)

25.48

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

F976-0154 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F976-0154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F976-0154?
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What is the minimum amount of F976-0154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F976-0154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F976-0154
  • 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 F976-0154 available by request