J061-1368 Screening compound: N-(1,3-benzothiazol-2-yl)-2-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound J061-1368
N-(1,3-benzothiazol-2-yl)-2-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}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
J061-1368
Molecular Formula
C16H12N4O2S2 (C16 H12 N4 O2 S2)
Compound Name
N-(1,3-benzothiazol-2-yl)-2-({5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl}sulfanyl)acetamide
IUPAC name
N-(13-benzothiazol-2-yl)-2-({5-methyl-[13]oxazolo[45-b]pyridin-2-yl}sulfanyl)acetamide
SMILES
Cc(cc1)nc2c1oc(SCC(Nc1nc(cccc3)c3s1)=O)n2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
356.43
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.986
Distribution Coefficient, logD
3.985
Water Solubility, LogSw
-4.04
Polar Surface Area
59.289
Acid Dissociation Constant (pKa)
11.43
Base Dissociation Constant (pKb)
2.65
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
12.50
J061-1368 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Antiviral Library (67538 compounds)
NOTUM (Wnt signaling) Library (3881 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with J061-1368 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)