K938-2043 Screening compound: N-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-1-(4-methoxyphenyl)-3-oxopropyl)-4-fluorobenzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound K938-2043
N-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-1-(4-methoxyphenyl)-3-oxopropyl)-4-fluorobenzene-1-sulfonamide
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
K938-2043
Molecular Formula
C23H27FN2O6S (C23 H27 FN2 O6 S)
Compound Name
N-(3-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-1-(4-methoxyphenyl)-3-oxopropyl)-4-fluorobenzene-1-sulfonamide
IUPAC name
N-(3-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-1-(4-methoxyphenyl)-3-oxopropyl)-4-fluorobenzene-1-sulfonamide
SMILES
COc1ccc(C(CC(N(CC2)CCC22OCCO2)=O)NS(c(cc2)ccc2F)(=O)=O)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
478.54
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.573
Distribution Coefficient, logD
2.573
Water Solubility, LogSw
-2.96
Polar Surface Area
79.942
Acid Dissociation Constant (pKa)
10.95
Base Dissociation Constant (pKb)
-0.88
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
43.50
K938-2043 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
GPCR Targeted Library (31838 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with K938-2043 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)