5508-0010 Screening compound: 3,4-dimethyl-N'~5~-(1-methylethylidene)-2-thioxo-2,3-dihydro-1,3-thiazole-5-carbohydrazide
Chemical Structure Depiction of ChemDiv screening compound 5508-0010
3,4-dimethyl-N'~5~-(1-methylethylidene)-2-thioxo-2,3-dihydro-1,3-thiazole-5-carbohydrazide
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
5508-0010
Molecular Formula
C9H13N3OS2 (C9 H13 N3 OS2)
Compound Name
3,4-dimethyl-N'~5~-(1-methylethylidene)-2-thioxo-2,3-dihydro-1,3-thiazole-5-carbohydrazide
IUPAC name
34-dimethyl-N'-(propan-2-ylidene)-2-sulfanylidene-23-dihydro-13-thiazole-5-carbohydrazide
SMILES
CC(C)=NNC(C(S1)=C(C)N(C)C1=S)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
243.35
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.705
Distribution Coefficient, logD
1.704
Water Solubility, LogSw
-2.21
Polar Surface Area
37.841
Acid Dissociation Constant (pKa)
9.83
Base Dissociation Constant (pKb)
3.96
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.44
5508-0010 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
Chelators targeting matrix metalloproteinases library (8930 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Cancer
- Digestive system
- Cardiovascular
- Agro
- Proteases
References: we are preparing a list of scientific research reports with 5508-0010 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)