T990-3432 Screening compound: 3-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Chemical Structure Depiction of ChemDiv screening compound T990-3432
3-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
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
T990-3432
Molecular Formula
C18H26BrN3O3 (C18 H26 BrN3 O3)
Compound Name
3-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
IUPAC name
3-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
SMILES
CC(C)CCN(CCC1N(CC2)CCN2C(c(o2)ccc2Br)=O)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
412.33
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.469
Distribution Coefficient, logD
2.466
Water Solubility, LogSw
-2.37
Polar Surface Area
45.414
Acid Dissociation Constant (pKa)
15.18
Base Dissociation Constant (pKb)
5.11
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
66.70
T990-3432 in Drug Discovery
Included in Screening Libraries
Autophagy-Targeted Library (4564 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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)
New Agro Library (44492 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Cyclic compounds
- Mimetics
- Agro
References: we are preparing a list of scientific research reports with T990-3432 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)