J500-0210 Screening compound: N~4~-(2-methoxyethyl)-2-(3-thienylcarbonyl)-2-azaspiro[4.4]nonane-4-carboxamide

J500-0210 Screening compound: N~4~-(2-methoxyethyl)-2-(3-thienylcarbonyl)-2-azaspiro[4.4]nonane-4-carboxamide
J500-0210 Screening compound: N~4~-(2-methoxyethyl)-2-(3-thienylcarbonyl)-2-azaspiro[4.4]nonane-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J500-0210
N~4~-(2-methoxyethyl)-2-(3-thienylcarbonyl)-2-azaspiro[4.4]nonane-4-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

J500-0210

Molecular Formula

C17H24N2O3S (C17 H24 N2 O3 S)

Compound Name

N~4~-(2-methoxyethyl)-2-(3-thienylcarbonyl)-2-azaspiro[4.4]nonane-4-carboxamide

IUPAC name

N-(2-methoxyethyl)-2-(thiophene-3-carbonyl)-2-azaspiro[4.4]nonane-4-carboxamide

SMILES

COCCNC(C(C1)C2(CCCC2)CN1C(c1cscc1)=O)=O

InChI

InChI=1S/C17H24N2O3S/c1-22-8-7-18-15(20)14-10-19(12-17(14)5-2-3-6-17)16(21)13-4-9-23-11-13/h4,9,11,14H,2-3,5-8,10,12H2,1H3,(H,18,20)/t14-/m0/s1

InChI Key

WNPKJDZBECSWCE-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD32223724

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.205

Distribution Coefficient, logD

1.205

Water Solubility, LogSw

-2.22

Polar Surface Area

51.293

Acid Dissociation Constant (pKa)

13.55

Base Dissociation Constant (pKb)

-1.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.71

J500-0210 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with J500-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J500-0210?
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What is the minimum amount of J500-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J500-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J500-0210
  • 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 J500-0210 available by request