G016-1366 Screening compound: N~4~-[3-(2-ethylpiperidino)propyl]-8-(ethylsulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

G016-1366 Screening compound: N~4~-[3-(2-ethylpiperidino)propyl]-8-(ethylsulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
G016-1366 Screening compound: N~4~-[3-(2-ethylpiperidino)propyl]-8-(ethylsulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G016-1366
N~4~-[3-(2-ethylpiperidino)propyl]-8-(ethylsulfonyl)-3-methyl-2-oxo-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

G016-1366

Molecular Formula

C22H37N3O5S (C22 H37 N3 O5 S)

Compound Name

N~4~-[3-(2-ethylpiperidino)propyl]-8-(ethylsulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

IUPAC name

8-(ethanesulfonyl)-N-[3-(2-ethylpiperidin-1-yl)propyl]-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

SMILES

CCC1N(CCCNC(C(C(CC2)(CCN2S(CC)(=O)=O)O2)=C(C)C2=O)=O)CCCC1

InChI

InChI=1S/C22H37N3O5S/c1-4-18-9-6-7-13-24(18)14-8-12-23-20(26)19-17(3)21(27)30-22(19)10-15-25(16-11-22)31(28,29)5-2/h18H,4-16H2,1-3H3,(H,23,26)/t18-/m0/s1

InChI Key

QSAVLZPYYYTPQC-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27209011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.62

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.591

Distribution Coefficient, logD

-1.276

Water Solubility, LogSw

-2.01

Polar Surface Area

80.798

Acid Dissociation Constant (pKa)

14.18

Base Dissociation Constant (pKb)

10.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

81.82

References: we are preparing a list of scientific research reports with G016-1366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G016-1366?
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What is the minimum amount of G016-1366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G016-1366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G016-1366
  • 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 G016-1366 available by request