G016-1255 Screening compound: N-(4-bromo-2-fluorophenyl)-8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide

G016-1255 Screening compound: N-(4-bromo-2-fluorophenyl)-8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
G016-1255 Screening compound: N-(4-bromo-2-fluorophenyl)-8-(ethanesulfonyl)-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G016-1255
N-(4-bromo-2-fluorophenyl)-8-(ethanesulfonyl)-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

G016-1255

Molecular Formula

C18H20BrFN2O5S (C18 H20 BrFN2 O5 S)

Compound Name

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

IUPAC name

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

SMILES

CCS(N(CC1)CCC1(C(C(Nc(ccc(Br)c1)c1F)=O)=C1C)OC1=O)(=O)=O

InChI

InChI=1S/C18H20BrFN2O5S/c1-3-28(25,26)22-8-6-18(7-9-22)15(11(2)17(24)27-18)16(23)21-14-5-4-12(19)10-13(14)20/h4-5,10H,3,6-9H2,1-2H3,(H,21,23)

InChI Key

QKCASIKCQZKZQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27208964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.34

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.751

Distribution Coefficient, logD

2.498

Water Solubility, LogSw

-3.32

Polar Surface Area

75.142

Acid Dissociation Constant (pKa)

7.50

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

G016-1255 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G016-1255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G016-1255?
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What is the minimum amount of G016-1255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G016-1255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G016-1255
  • 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 G016-1255 available by request