T990-2306 Screening compound: 1-(2-METHOXYETHYL)-3-(4-{[3-(TRIFLUOROMETHYL)PHENYL]SULFONYL}PIPERAZINO)-2-PYRROLIDINONE
Chemical Structure Depiction of ChemDiv screening compound T990-2306
1-(2-METHOXYETHYL)-3-(4-{[3-(TRIFLUOROMETHYL)PHENYL]SULFONYL}PIPERAZINO)-2-PYRROLIDINONE
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
T990-2306
Molecular Formula
C18H24F3N3O4S (C18 H24 F3 N3 O4 S)
Compound Name
1-(2-METHOXYETHYL)-3-(4-{[3-(TRIFLUOROMETHYL)PHENYL]SULFONYL}PIPERAZINO)-2-PYRROLIDINONE
IUPAC name
1-(2-methoxyethyl)-3-{4-[3-(trifluoromethyl)benzenesulfonyl]piperazin-1-yl}pyrrolidin-2-one
SMILES
COCCN(CCC1N(CC2)CCN2S(c2cc(C(F)(F)F)ccc2)(=O)=O)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
435.47
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.579
Distribution Coefficient, logD
1.578
Water Solubility, LogSw
-2.44
Polar Surface Area
59.893
Acid Dissociation Constant (pKa)
15.18
Base Dissociation Constant (pKb)
4.17
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
61.11
T990-2306 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Cyclic compounds
References: we are preparing a list of scientific research reports with T990-2306 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)