D115-0023 Screening compound: 2-(1,2-dimethyl-1H-indol-3-yl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

D115-0023 Screening compound: 2-(1,2-dimethyl-1H-indol-3-yl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
D115-0023 Screening compound: 2-(1,2-dimethyl-1H-indol-3-yl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D115-0023
2-(1,2-dimethyl-1H-indol-3-yl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

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

D115-0023

Molecular Formula

C25H27N3O (C25 H27 N3 O)

Compound Name

2-(1,2-dimethyl-1H-indol-3-yl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

IUPAC name

2-(12-dimethyl-1H-indol-3-yl)-5-methyl-7-phenyl-13-diazatricyclo[3.3.1.1^{37}]decan-6-one

SMILES

CC(C1)(CN(C2)C(c3c(C)n(C)c4c3cccc4)N1CC21c2ccccc2)C1=O

InChI

InChI=1S/C25H29N3O/c1-17-21(19-11-7-8-12-20(19)26(17)3)22-27-13-24(2)14-28(22)16-25(15-27,23(24)29)18-9-5-4-6-10-18/h4-12,22,27-28H,13-16H2,1-3H3

InChI Key

ULRWBPZYUIJTCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06177344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.623

Distribution Coefficient, logD

3.622

Water Solubility, LogSw

-3.75

Polar Surface Area

21.929

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with D115-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D115-0023?
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What is the minimum amount of D115-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D115-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D115-0023
  • 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 D115-0023 available by request