J060-0212 Screening compound: N,N-dimethyl-2-({[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound J060-0212
N,N-dimethyl-2-({[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}sulfanyl)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
J060-0212
Molecular Formula
C14H17N3O2S (C14 H17 N3 O2 S)
Compound Name
N,N-dimethyl-2-({[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}sulfanyl)acetamide
IUPAC name
NN-dimethyl-2-({[5-(4-methylphenyl)-124-oxadiazol-3-yl]methyl}sulfanyl)acetamide
SMILES
Cc(cc1)ccc1-c1nc(CSCC(N(C)C)=O)no1
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
291.37
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.333
Distribution Coefficient, logD
2.333
Water Solubility, LogSw
-2.61
Polar Surface Area
48.379
Acid Dissociation Constant (pKa)
23.03
Base Dissociation Constant (pKb)
-1.51
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
35.70
J060-0212 in Drug Discovery
Included in Screening Libraries
Soluble Diversity Library (15920 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with J060-0212 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)