8388-0024 Screening compound: tert-butyl N-[1-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)ethyl]carbamate
Chemical Structure Depiction of ChemDiv screening compound 8388-0024
tert-butyl N-[1-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)ethyl]carbamate
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
8388-0024
Molecular Formula
C16H20FN3O3S (C16 H20 FN3 O3 S)
Compound Name
tert-butyl N-[1-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)ethyl]carbamate
IUPAC name
tert-butyl N-[(1S)-1-(5-{[(4-fluorophenyl)methyl]sulfanyl}-134-oxadiazol-2-yl)ethyl]carbamate
SMILES
C[C@@H](c(o1)nnc1SCc(cc1)ccc1F)NC(OC(C)(C)C)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
353.42
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.492
Distribution Coefficient, logD
3.492
Water Solubility, LogSw
-3.83
Polar Surface Area
61.374
Acid Dissociation Constant (pKa)
13.95
Base Dissociation Constant (pKb)
0.43
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
43.80
References: we are preparing a list of scientific research reports with 8388-0024 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)