Y020-0039 Screening compound: 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2,2-dimethyl-1-propanone

Y020-0039 Screening compound: 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2,2-dimethyl-1-propanone
Y020-0039 Screening compound: 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2,2-dimethyl-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-0039
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2,2-dimethyl-1-propanone

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

Y020-0039

Molecular Formula

C19H21NO (C19 H21 NO)

Compound Name

1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2,2-dimethyl-1-propanone

IUPAC name

1-{2-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3571214-hexaen-2-yl}-22-dimethylpropan-1-one

SMILES

CC(C)(C)C(N(c1c(CC2)cccc1)c1c2cccc1)=O

InChI

InChI=1S/C19H21NO/c1-19(2,3)18(21)20-16-10-6-4-8-14(16)12-13-15-9-5-7-11-17(15)20/h4-11H,12-13H2,1-3H3

InChI Key

VGKXNIMVSZFWCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01796504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.012

Distribution Coefficient, logD

5.012

Water Solubility, LogSw

-4.56

Polar Surface Area

14.472

Acid Dissociation Constant (pKa)

24.64

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

Y020-0039 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

DGK Inhibitors Library (10558 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Regenerative Medicine Focused Library (23016 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with Y020-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-0039?
Check Price and Availability of Y020-0039, 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 Y020-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-0039
  • 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 Y020-0039 available by request