N106-0755 Screening compound: 4-[(1R,3aS,10aS,10bS)-2-(cyclopentylcarbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-(cyclopropylmethyl)butanamide

N106-0755 Screening compound: 4-[(1R,3aS,10aS,10bS)-2-(cyclopentylcarbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-(cyclopropylmethyl)butanamide
N106-0755 Screening compound: 4-[(1R,3aS,10aS,10bS)-2-(cyclopentylcarbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-(cyclopropylmethyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound N106-0755
4-[(1R,3aS,10aS,10bS)-2-(cyclopentylcarbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-(cyclopropylmethyl)butanamide

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

N106-0755

Molecular Formula

C25H41N3O2 (C25 H41 N3 O2)

Compound Name

4-[(1R,3aS,10aS,10bS)-2-(cyclopentylcarbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-(cyclopropylmethyl)butanamide

IUPAC name

4-[(5R6R9S13S)-7-cyclopentanecarbonyl-17-diazatricyclo[7.3.1.0^{513}]tridecan-6-yl]-N-(cyclopropylmethyl)butanamide

SMILES

O=C(CCC[C@H]([C@@H]1[C@H]([C@@H](CCC2)C3)N2CCC1)N3C(C1CCCC1)=O)NCC1CC1

InChI

InChI=1S/C25H41N3O2/c29-23(26-16-18-12-13-18)11-3-10-22-21-9-5-15-27-14-4-8-20(24(21)27)17-28(22)25(30)19-6-1-2-7-19/h18-22,24H,1-17H2,(H,26,29)/t20-,21-,22-,24-/m1/s1

InChI Key

CLYGEMHXXCAGIA-GBEXAXCTSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.389

Distribution Coefficient, logD

-0.188

Water Solubility, LogSw

-2.49

Polar Surface Area

44.474

Acid Dissociation Constant (pKa)

15.92

Base Dissociation Constant (pKb)

9.98

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

92.00

N106-0755 in Drug Discovery

Included in Screening Libraries

Natural-Product-Based Library (3730 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with N106-0755 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N106-0755?
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What is the minimum amount of N106-0755 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N106-0755
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N106-0755
  • 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 N106-0755 available by request