Screening compound: InChI=1S/C13H12ClFN2O4S/c1-8-9(6-17(2)22(19,20)16-8)13(18)21-7-10-11(14)4-3-5-12(10)15/h3-6H,7H2,1-2H3
Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C13H12ClFN2O4S/c1-8-9(6-17(2)22(19,20)16-8)13(18)21-7-10-11(14)4-3-5-12(10)15/h3-6H,7H2,1-2H3
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
T744-0114
Molecular Formula
C13H12ClFN2O4S (C13 H12 ClFN2 O4 S)
Compound Name
2-chloro-6-fluorobenzyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
IUPAC name
(2-chloro-6-fluorophenyl)methyl 25-dimethyl-11-dioxo-2H-1lambda626-thiadiazine-4-carboxylate
SMILES
CC(C(C(OCc(c(F)ccc1)c1Cl)=O)=CN1C)=NS1(=O)=O
InChI Key
MDL Number (MFCD)
InChI=1S/C13H12ClFN2O4S/c1-8-9(6-17(2)22(19,20)16-8)13(18)21-7-10-11(14)4-3-5-12(10)15/h3-6H,7H2,1-2H3 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Eccentric PPI Library (11937 compounds)
KRAS-Targeted Library (16000 compounds)
Protein-Protein Interaction Library (218420 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
SmartTM Library (51161 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Epigenetic
- Cyclic compounds
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Kinases
- Proteases
References: we are preparing a list of scientific research reports with InChI=1S/C13H12ClFN2O4S/c1-8-9(6-17(2)22(19,20)16-8)13(18)21-7-10-11(14)4-3-5-12(10)15/h3-6H,7H2,1-2H3 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)