F731-0176 Screening compound: 3,3-dimethyl-N~1~-(11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)butanamide

F731-0176 Screening compound: 3,3-dimethyl-N~1~-(11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)butanamide
F731-0176 Screening compound: 3,3-dimethyl-N~1~-(11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F731-0176
3,3-dimethyl-N~1~-(11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)butanamide

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

F731-0176

Molecular Formula

C19H20N2O3 (C19 H20 N2 O3)

Compound Name

3,3-dimethyl-N~1~-(11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)butanamide

IUPAC name

33-dimethyl-N-{10-oxo-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaen-13-yl}butanamide

SMILES

CC(C)(C)CC(Nc(cc1)cc2c1Oc(cccc1)c1NC2=O)=O

InChI

InChI=1S/C19H20N2O3/c1-19(2,3)11-17(22)20-12-8-9-15-13(10-12)18(23)21-14-6-4-5-7-16(14)24-15/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23)

InChI Key

DUMNFABYHMSLJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08938511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.162

Distribution Coefficient, logD

4.151

Water Solubility, LogSw

-4.50

Polar Surface Area

55.489

Acid Dissociation Constant (pKa)

8.98

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

F731-0176 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F731-0176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F731-0176?
Check Price and Availability of F731-0176, 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 F731-0176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F731-0176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F731-0176
  • 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 F731-0176 available by request