J500-0282 Screening compound: N~4~-(2-methoxyethyl)-N~2~-phenethyl-2-azaspiro[4.4]nonane-2,4-dicarboxamide

J500-0282 Screening compound: N~4~-(2-methoxyethyl)-N~2~-phenethyl-2-azaspiro[4.4]nonane-2,4-dicarboxamide
J500-0282 Screening compound: N~4~-(2-methoxyethyl)-N~2~-phenethyl-2-azaspiro[4.4]nonane-2,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J500-0282
N~4~-(2-methoxyethyl)-N~2~-phenethyl-2-azaspiro[4.4]nonane-2,4-dicarboxamide

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

J500-0282

Molecular Formula

C21H31N3O3 (C21 H31 N3 O3)

Compound Name

N~4~-(2-methoxyethyl)-N~2~-phenethyl-2-azaspiro[4.4]nonane-2,4-dicarboxamide

IUPAC name

N4-(2-methoxyethyl)-N2-(2-phenylethyl)-2-azaspiro[4.4]nonane-24-dicarboxamide

SMILES

COCCNC(C(C1)C2(CCCC2)CN1C(NCCc1ccccc1)=O)=O

InChI

InChI=1S/C21H31N3O3/c1-27-14-13-22-19(25)18-15-24(16-21(18)10-5-6-11-21)20(26)23-12-9-17-7-3-2-4-8-17/h2-4,7-8,18H,5-6,9-16H2,1H3,(H,22,25)(H,23,26)/t18-/m0/s1

InChI Key

WLTFDTVZCCIKQO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32223798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.832

Distribution Coefficient, logD

1.832

Water Solubility, LogSw

-2.06

Polar Surface Area

60.259

Acid Dissociation Constant (pKa)

13.55

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

J500-0282 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with J500-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J500-0282?
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What is the minimum amount of J500-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J500-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J500-0282
  • 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 J500-0282 available by request