T159-1121 Screening compound: 3-[(1-benzyl-5-methyl-1H-imidazol-2-yl)methyl]-1-cyclopentanecarbonylpiperidine
Chemical Structure Depiction of ChemDiv screening compound T159-1121
3-[(1-benzyl-5-methyl-1H-imidazol-2-yl)methyl]-1-cyclopentanecarbonylpiperidine
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
T159-1121
Molecular Formula
C23H31N3O (C23 H31 N3 O)
Compound Name
3-[(1-benzyl-5-methyl-1H-imidazol-2-yl)methyl]-1-cyclopentanecarbonylpiperidine
IUPAC name
3-[(1-benzyl-5-methyl-1H-imidazol-2-yl)methyl]-1-cyclopentanecarbonylpiperidine
SMILES
Cc1cnc(CC(CCC2)CN2C(C2CCCC2)=O)n1Cc1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
365.52
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.204
Distribution Coefficient, logD
3.737
Water Solubility, LogSw
-4.10
Polar Surface Area
29.268
Acid Dissociation Constant (pKa)
22.88
Base Dissociation Constant (pKb)
7.69
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
56.52
T159-1121 in Drug Discovery
Included in Screening Libraries
CORONAVIRUS Library (20774 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)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
- Cyclic compounds
References: we are preparing a list of scientific research reports with T159-1121 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)