3454-1797 Screening compound: 10-butyl-4H,5H,10H-[1,2,5]oxadiazolo[3,4-a]carbazole

3454-1797 Screening compound: 10-butyl-4H,5H,10H-[1,2,5]oxadiazolo[3,4-a]carbazole
3454-1797 Screening compound: 10-butyl-4H,5H,10H-[1,2,5]oxadiazolo[3,4-a]carbazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3454-1797
10-butyl-4H,5H,10H-[1,2,5]oxadiazolo[3,4-a]carbazole

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

3454-1797

Molecular Formula

C16H17N3O (C16 H17 N3 O)

Compound Name

10-butyl-4H,5H,10H-[1,2,5]oxadiazolo[3,4-a]carbazole

IUPAC name

10-butyl-4H5H10H-[125]oxadiazolo[34-a]carbazole

SMILES

CCCCn1c(-c2nonc2CC2)c2c2c1cccc2

InChI

InChI=1S/C16H17N3O/c1-2-3-10-19-14-7-5-4-6-11(14)12-8-9-13-15(16(12)19)18-20-17-13/h4-7H,2-3,8-10H2,1H3

InChI Key

GEQSCUMNVJZVCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02031369

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.577

Distribution Coefficient, logD

4.577

Water Solubility, LogSw

-4.19

Polar Surface Area

38.959

Acid Dissociation Constant (pKa)

23.80

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

3454-1797 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

BRD4 Targeted Library (4534 compounds)

DGK Inhibitors Library (10558 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3454-1797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3454-1797?
Check Price and Availability of 3454-1797, 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 3454-1797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3454-1797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3454-1797
  • 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 3454-1797 available by request