G016-0595 Screening compound: 8-methanesulfonyl-3-methyl-2-oxo-N-(2-phenylpropyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

G016-0595 Screening compound: 8-methanesulfonyl-3-methyl-2-oxo-N-(2-phenylpropyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
G016-0595 Screening compound: 8-methanesulfonyl-3-methyl-2-oxo-N-(2-phenylpropyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G016-0595
8-methanesulfonyl-3-methyl-2-oxo-N-(2-phenylpropyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-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

G016-0595

Molecular Formula

C20H26N2O5S (C20 H26 N2 O5 S)

Compound Name

8-methanesulfonyl-3-methyl-2-oxo-N-(2-phenylpropyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

IUPAC name

8-methanesulfonyl-3-methyl-2-oxo-N-(2-phenylpropyl)-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

SMILES

CC(CNC(C(C(CC1)(CCN1S(C)(=O)=O)O1)=C(C)C1=O)=O)c1ccccc1

InChI

InChI=1S/C20H26N2O5S/c1-14(16-7-5-4-6-8-16)13-21-18(23)17-15(2)19(24)27-20(17)9-11-22(12-10-20)28(3,25)26/h4-8,14H,9-13H2,1-3H3,(H,21,23)/t14-/m0/s1

InChI Key

ARHLUDXMGVTNNM-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD14977038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.193

Distribution Coefficient, logD

2.193

Water Solubility, LogSw

-2.58

Polar Surface Area

76.760

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with G016-0595 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G016-0595?
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What is the minimum amount of G016-0595 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G016-0595
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G016-0595
  • 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 G016-0595 available by request