T990-2302 Screening compound: 3-{4-[(2,4-dimethylphenyl)sulfonyl]piperazino}-1-(2-methoxyethyl)-2-pyrrolidinone
Chemical Structure Depiction of ChemDiv screening compound T990-2302
3-{4-[(2,4-dimethylphenyl)sulfonyl]piperazino}-1-(2-methoxyethyl)-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
T990-2302
Molecular Formula
C19H29N3O4S (C19 H29 N3 O4 S)
Compound Name
3-{4-[(2,4-dimethylphenyl)sulfonyl]piperazino}-1-(2-methoxyethyl)-2-pyrrolidinone
IUPAC name
3-[4-(24-dimethylbenzenesulfonyl)piperazin-1-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
SMILES
Cc(cc1)cc(C)c1S(N(CC1)CCN1C(CCN1CCOC)C1=O)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
395.52
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.598
Distribution Coefficient, logD
1.598
Water Solubility, LogSw
-2.38
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
63.16
T990-2302 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
- Cyclic compounds
- Mimetics
References: we are preparing a list of scientific research reports with T990-2302 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)