0073-0048 Screening compound: 1,3,3-trimethyl-1,3-dihydro-1'-oxa-4'-azaspiro[indole-2,2'-triphenylene]

0073-0048 Screening compound: 1,3,3-trimethyl-1,3-dihydro-1'-oxa-4'-azaspiro[indole-2,2'-triphenylene]
0073-0048 Screening compound: 1,3,3-trimethyl-1,3-dihydro-1'-oxa-4'-azaspiro[indole-2,2'-triphenylene] alternative view

Chemical Structure Depiction of ChemDiv screening compound 0073-0048
1,3,3-trimethyl-1,3-dihydro-1'-oxa-4'-azaspiro[indole-2,2'-triphenylene]

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

0073-0048

Molecular Formula

C26H22N2O (C26 H22 N2 O)

Compound Name

1,3,3-trimethyl-1,3-dihydro-1'-oxa-4'-azaspiro[indole-2,2'-triphenylene]

IUPAC name

133-trimethyl-13-dihydro-1'-oxa-4'-azaspiro[indole-22'-triphenylene]

SMILES

CC1(C)c(cccc2)c2N(C)C11Oc(c2ccccc2c2ccccc22)c2N=C1

InChI

InChI=1S/C26H22N2O/c1-25(2)21-14-8-9-15-22(21)28(3)26(25)16-27-23-19-12-6-4-10-17(19)18-11-5-7-13-20(18)24(23)29-26/h4-16H,1-3H3/t26-/m1/s1

InChI Key

JTRRHUVYCPAWOM-AREMUKBSSA-N

MDL Number (MFCD)

MFCD00013316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.47

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.248

Distribution Coefficient, logD

6.248

Water Solubility, LogSw

-6.03

Polar Surface Area

14.353

Acid Dissociation Constant (pKa)

28.59

Base Dissociation Constant (pKb)

0.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

0073-0048 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0073-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0073-0048?
Check Price and Availability of 0073-0048, 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 0073-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0073-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0073-0048
  • 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 0073-0048 available by request