S698-0229 Screening compound: N-ethyl-4-(5-methyl-2-phenyl-1H-imidazol-1-yl)piperidine-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound S698-0229
N-ethyl-4-(5-methyl-2-phenyl-1H-imidazol-1-yl)piperidine-1-carboxamide
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
S698-0229
Molecular Formula
C18H24N4O (C18 H24 N4 O)
Compound Name
N-ethyl-4-(5-methyl-2-phenyl-1H-imidazol-1-yl)piperidine-1-carboxamide
IUPAC name
N-ethyl-4-(5-methyl-2-phenyl-1H-imidazol-1-yl)piperidine-1-carboxamide
SMILES
CCNC(N(CC1)CCC1n1c(-c2ccccc2)ncc1C)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
312.41
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.702
Distribution Coefficient, logD
2.654
Water Solubility, LogSw
-2.74
Polar Surface Area
38.224
Acid Dissociation Constant (pKa)
16.62
Base Dissociation Constant (pKb)
6.47
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.44
S698-0229 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- PPI modulators
References: we are preparing a list of scientific research reports with S698-0229 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)