G743-0136 Screening compound: 4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]-N~1~-(3-ethylphenyl)benzamide
Chemical Structure Depiction of ChemDiv screening compound G743-0136
4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]-N~1~-(3-ethylphenyl)benzamide
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
G743-0136
Molecular Formula
C23H20F3N3O3S (C23 H20 F3 N3 O3 S)
Compound Name
4-[1,1-dioxo-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1lambda~6~,2,4-benzothiadiazin-3-yl]-N~1~-(3-ethylphenyl)benzamide
IUPAC name
4-[11-dioxo-6-(trifluoromethyl)-34-dihydro-2H-1lambda624-benzothiadiazin-3-yl]-N-(3-ethylphenyl)benzamide
SMILES
CCc1cccc(NC(c2ccc(C(Nc3c4ccc(C(F)(F)F)c3)NS4(=O)=O)cc2)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
475.49
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.512
Distribution Coefficient, logD
4.512
Water Solubility, LogSw
-4.36
Polar Surface Area
75.192
Acid Dissociation Constant (pKa)
10.76
Base Dissociation Constant (pKb)
-1.86
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
17.40
References: we are preparing a list of scientific research reports with G743-0136 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)