1923-0062 Screening compound: 6-benzoyl-1',3',3'-trimethyl-1',3'-dihydrospiro[chromene-2,2'-indole]

1923-0062 Screening compound: 6-benzoyl-1',3',3'-trimethyl-1',3'-dihydrospiro[chromene-2,2'-indole]
1923-0062 Screening compound: 6-benzoyl-1',3',3'-trimethyl-1',3'-dihydrospiro[chromene-2,2'-indole] alternative view

Chemical Structure Depiction of ChemDiv screening compound 1923-0062
6-benzoyl-1',3',3'-trimethyl-1',3'-dihydrospiro[chromene-2,2'-indole]

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

1923-0062

Molecular Formula

C26H23NO2 (C26 H23 NO2)

Compound Name

6-benzoyl-1',3',3'-trimethyl-1',3'-dihydrospiro[chromene-2,2'-indole]

IUPAC name

6-benzoyl-1'3'3'-trimethyl-1'3'-dihydrospiro[chromene-22'-indole]

SMILES

CC1(C)c(cccc2)c2N(C)C1(C=C1)Oc(cc2)c1cc2C(c1ccccc1)=O

InChI

InChI=1S/C26H23NO2/c1-25(2)21-11-7-8-12-22(21)27(3)26(25)16-15-19-17-20(13-14-23(19)29-26)24(28)18-9-5-4-6-10-18/h4-17H,1-3H3/t26-/m1/s1

InChI Key

WDXBMTKYXZPWHG-AREMUKBSSA-N

MDL Number (MFCD)

MFCD01247263

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.943

Distribution Coefficient, logD

5.943

Water Solubility, LogSw

-5.56

Polar Surface Area

21.899

Acid Dissociation Constant (pKa)

28.59

Base Dissociation Constant (pKb)

-1.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

1923-0062 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1923-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1923-0062?
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What is the minimum amount of 1923-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1923-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1923-0062
  • 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 1923-0062 available by request