8017-0350 Screening compound: 2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)-N~1~-[3-(trifluoromethyl)phenyl]acetamide

8017-0350 Screening compound: 2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)-N~1~-[3-(trifluoromethyl)phenyl]acetamide
8017-0350 Screening compound: 2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)-N~1~-[3-(trifluoromethyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-0350
2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)-N~1~-[3-(trifluoromethyl)phenyl]acetamide

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

8017-0350

Molecular Formula

C18H21F3N2O4 (C18 H21 F3 N2 O4)

Compound Name

2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)-N~1~-[3-(trifluoromethyl)phenyl]acetamide

IUPAC name

2-{4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl}-N-[3-(trifluoromethyl)phenyl]acetamide

SMILES

CC(C1(CCCCC1)O1)(N(CC(Nc2cccc(C(F)(F)F)c2)=O)C1=O)O

InChI

InChI=1S/C18H21F3N2O4/c1-16(26)17(8-3-2-4-9-17)27-15(25)23(16)11-14(24)22-13-7-5-6-12(10-13)18(19,20)21/h5-7,10,26H,2-4,8-9,11H2,1H3,(H,22,24)/t16-/m0/s1

InChI Key

RODUQRZHCFXBCH-INIZCTEOSA-N

MDL Number (MFCD)

MFCD06013576

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.681

Distribution Coefficient, logD

3.680

Water Solubility, LogSw

-4.00

Polar Surface Area

62.278

Acid Dissociation Constant (pKa)

10.32

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

References: we are preparing a list of scientific research reports with 8017-0350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-0350?
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What is the minimum amount of 8017-0350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-0350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-0350
  • 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 8017-0350 available by request