8003-4215 Screening compound: 2-chloro-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of ChemDiv screening compound 8003-4215
2-chloro-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]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
8003-4215
Molecular Formula
C7H10ClN3OS (C7 H10 ClN3 OS)
Compound Name
2-chloro-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
IUPAC name
2-chloro-N-[5-(propan-2-yl)-134-thiadiazol-2-yl]acetamide
SMILES
CC(C)c1nnc(NC(CCl)=O)s1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
219.69
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.813
Distribution Coefficient, logD
1.193
Water Solubility, LogSw
-2.39
Polar Surface Area
46.933
Acid Dissociation Constant (pKa)
6.90
Base Dissociation Constant (pKb)
-2.13
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
57.10
8003-4215 in Drug Discovery
Included in Screening Libraries
Chelators targeting matrix metalloproteinases library (8930 compounds)
Covalent Inhibitors Library (7986 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
New Agro Library (44492 compounds)
Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Proteases
- Cyclic compounds
- 3D
- Fragments
- Agro
References: we are preparing a list of scientific research reports with 8003-4215 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)