N107-0083 Screening compound: (1R,5R,11aR)-3-{[4-(trifluoromethoxy)phenyl]acetyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

N107-0083 Screening compound: (1R,5R,11aR)-3-{[4-(trifluoromethoxy)phenyl]acetyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
N107-0083 Screening compound: (1R,5R,11aR)-3-{[4-(trifluoromethoxy)phenyl]acetyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound N107-0083
(1R,5R,11aR)-3-{[4-(trifluoromethoxy)phenyl]acetyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-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

N107-0083

Molecular Formula

C20H23F3N2O3 (C20 H23 F3 N2 O3)

Compound Name

(1R,5R,11aR)-3-{[4-(trifluoromethoxy)phenyl]acetyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

IUPAC name

(1R2R9R)-11-{2-[4-(trifluoromethoxy)phenyl]acetyl}-711-diazatricyclo[7.3.1.0^{27}]tridecan-6-one

SMILES

O=C(Cc(cc1)ccc1OC(F)(F)F)N(C[C@@H](C1)C2)C[C@@H]1[C@@H](CCC1)N2C1=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.178

Distribution Coefficient, logD

3.178

Water Solubility, LogSw

-3.44

Polar Surface Area

38.530

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

60.00

N107-0083 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Natural-Product-Based Library (3730 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Pool

References: we are preparing a list of scientific research reports with N107-0083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N107-0083?
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What is the minimum amount of N107-0083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N107-0083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N107-0083
  • 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 N107-0083 available by request