N115-0158 Screening compound: N-(2-METHOXYETHYL)-6-[(1R2R9R)-6-OXO-711-DIAZATRICYCLO[7.3.1.0{27}]TRIDECAN-11-YL]PYRIDINE-3-CARBOXAMIDE

N115-0158 Screening compound: N-(2-METHOXYETHYL)-6-[(1R2R9R)-6-OXO-711-DIAZATRICYCLO[7.3.1.0{27}]TRIDECAN-11-YL]PYRIDINE-3-CARBOXAMIDE
N115-0158 Screening compound: N-(2-METHOXYETHYL)-6-[(1R2R9R)-6-OXO-711-DIAZATRICYCLO[7.3.1.0{27}]TRIDECAN-11-YL]PYRIDINE-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound N115-0158
N-(2-METHOXYETHYL)-6-[(1R2R9R)-6-OXO-711-DIAZATRICYCLO[7.3.1.0{27}]TRIDECAN-11-YL]PYRIDINE-3-CARBOXAMIDE

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

N115-0158

Molecular Formula

C20H28N4O3 (C20 H28 N4 O3)

Compound Name

N-(2-METHOXYETHYL)-6-[(1R2R9R)-6-OXO-711-DIAZATRICYCLO[7.3.1.0{27}]TRIDECAN-11-YL]PYRIDINE-3-CARBOXAMIDE

IUPAC name

N-(2-methoxyethyl)-6-[(1R2R9R)-6-oxo-711-diazatricyclo[7.3.1.0^{27}]tridecan-11-yl]pyridine-3-carboxamide

SMILES

COCCNC(c(cc1)cnc1N(C[C@@H](C1)C2)C[C@@H]1[C@@H](CCC1)N2C1=O)=O

InChI

InChI=1S/C20H28N4O3/c1-27-8-7-21-20(26)15-5-6-18(22-10-15)23-11-14-9-16(13-23)17-3-2-4-19(25)24(17)12-14/h5-6,10,14,16-17H,2-4,7-9,11-13H2,1H3,(H,21,26)/t14-,16+,17+/m0/s1

InChI Key

QNGPGTVLZAZGPJ-USXIJHARSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.377

Distribution Coefficient, logD

1.377

Water Solubility, LogSw

-1.88

Polar Surface Area

61.394

Acid Dissociation Constant (pKa)

12.61

Base Dissociation Constant (pKb)

3.08

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

65.00

N115-0158 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 N115-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N115-0158?
Check Price and Availability of N115-0158, 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 N115-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N115-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N115-0158
  • 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 N115-0158 available by request