F975-0181 Screening compound: N-(2-chloro-4-methylphenyl)-4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-1,4-diazepane-1-carboxamide

F975-0181 Screening compound: N-(2-chloro-4-methylphenyl)-4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-1,4-diazepane-1-carboxamide
F975-0181 Screening compound: N-(2-chloro-4-methylphenyl)-4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-1,4-diazepane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F975-0181
N-(2-chloro-4-methylphenyl)-4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-1,4-diazepane-1-carboxamide

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

F975-0181

Molecular Formula

C23H23ClFN5O2 (C23 H23 ClFN5 O2)

Compound Name

N-(2-chloro-4-methylphenyl)-4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-1,4-diazepane-1-carboxamide

IUPAC name

N-(2-chloro-4-methylphenyl)-4-[1-(4-fluorophenyl)-6-oxo-16-dihydropyridazin-3-yl]-14-diazepane-1-carboxamide

SMILES

Cc(cc1)cc(Cl)c1NC(N(CCC1)CCN1C(C=C1)=NN(c(cc2)ccc2F)C1=O)=O

InChI

InChI=1S/C23H23ClFN5O2/c1-16-3-8-20(19(24)15-16)26-23(32)29-12-2-11-28(13-14-29)21-9-10-22(31)30(27-21)18-6-4-17(25)5-7-18/h3-10,15H,2,11-14H2,1H3,(H,26,32)

InChI Key

DAXNYAXKZYXSRX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973524

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.053

Distribution Coefficient, logD

4.051

Water Solubility, LogSw

-4.26

Polar Surface Area

55.615

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

6.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

F975-0181 in Drug Discovery

Included in Screening Libraries

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 F975-0181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F975-0181?
Check Price and Availability of F975-0181, 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 F975-0181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F975-0181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F975-0181
  • 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 F975-0181 available by request