T160-0116 Screening compound: 4-{[1-(2-methoxyethyl)-5-methyl-1H-imidazol-2-yl]methyl}-1-(oxolane-3-carbonyl)piperidine
Chemical Structure Depiction of ChemDiv screening compound T160-0116
4-{[1-(2-methoxyethyl)-5-methyl-1H-imidazol-2-yl]methyl}-1-(oxolane-3-carbonyl)piperidine
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
T160-0116
Molecular Formula
C18H29N3O3 (C18 H29 N3 O3)
Compound Name
4-{[1-(2-methoxyethyl)-5-methyl-1H-imidazol-2-yl]methyl}-1-(oxolane-3-carbonyl)piperidine
IUPAC name
4-{[1-(2-methoxyethyl)-5-methyl-1H-imidazol-2-yl]methyl}-1-(oxolane-3-carbonyl)piperidine
SMILES
Cc1cnc(CC(CC2)CCN2C(C2COCC2)=O)n1CCOC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
335.45
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.249
Distribution Coefficient, logD
-0.683
Water Solubility, LogSw
-1.31
Polar Surface Area
46.333
Acid Dissociation Constant (pKa)
22.89
Base Dissociation Constant (pKb)
9.33
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
77.78
T160-0116 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Nervous system
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with T160-0116 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)