D068-0275 Screening compound: 2-(2-furyl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

D068-0275 Screening compound: 2-(2-furyl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
D068-0275 Screening compound: 2-(2-furyl)-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 D068-0275
2-(2-furyl)-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

D068-0275

Molecular Formula

C19H20N2O2 (C19 H20 N2 O2)

Compound Name

2-(2-furyl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

IUPAC name

2-(furan-2-yl)-5-methyl-7-phenyl-13-diazatricyclo[3.3.1.1^{37}]decan-6-one

SMILES

CC(C1)(CN(C2)C(c3ccco3)N1CC21c2ccccc2)C1=O

InChI

InChI=1S/C19H22N2O2/c1-18-10-20-12-19(17(18)22,14-6-3-2-4-7-14)13-21(11-18)16(20)15-8-5-9-23-15/h2-9,16,20-21H,10-13H2,1H3

InChI Key

BHSQCLDMDQITRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07593485

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.535

Distribution Coefficient, logD

2.535

Water Solubility, LogSw

-2.44

Polar Surface Area

28.225

Acid Dissociation Constant (pKa)

29.20

Base Dissociation Constant (pKb)

2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

D068-0275 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D068-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D068-0275?
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What is the minimum amount of D068-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D068-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D068-0275
  • 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 D068-0275 available by request