P433-0457 Screening compound: ethyl 1-[3-(4-methoxyphenyl)imidazo[1,2-a]pyridine-2-carbonyl]piperidine-4-carboxylate
Chemical Structure Depiction of ChemDiv screening compound P433-0457
ethyl 1-[3-(4-methoxyphenyl)imidazo[1,2-a]pyridine-2-carbonyl]piperidine-4-carboxylate
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
P433-0457
Molecular Formula
C23H25N3O4 (C23 H25 N3 O4)
Compound Name
ethyl 1-[3-(4-methoxyphenyl)imidazo[1,2-a]pyridine-2-carbonyl]piperidine-4-carboxylate
IUPAC name
ethyl 1-[3-(4-methoxyphenyl)imidazo[12-a]pyridine-2-carbonyl]piperidine-4-carboxylate
SMILES
CCOC(C(CC1)CCN1C(c1c(-c(cc2)ccc2OC)n(cccc2)c2n1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
407.47
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.998
Distribution Coefficient, logD
2.998
Water Solubility, LogSw
-2.92
Polar Surface Area
53.070
Acid Dissociation Constant (pKa)
23.24
Base Dissociation Constant (pKb)
4.03
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
34.80
P433-0457 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Bromodomain Modulators Library (5801 compounds)
Cardiovascular Library (22201 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cardiovascular
References: we are preparing a list of scientific research reports with P433-0457 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)