G826-0426 Screening compound: methyl 4-{1-[4-(pyrrolidine-1-carbonyl)pyridin-2-yl]piperidine-4-amido}benzoate
Chemical Structure Depiction of ChemDiv screening compound G826-0426
methyl 4-{1-[4-(pyrrolidine-1-carbonyl)pyridin-2-yl]piperidine-4-amido}benzoate
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
G826-0426
Molecular Formula
C24H28N4O4 (C24 H28 N4 O4)
Compound Name
methyl 4-{1-[4-(pyrrolidine-1-carbonyl)pyridin-2-yl]piperidine-4-amido}benzoate
IUPAC name
methyl 4-{1-[4-(pyrrolidine-1-carbonyl)pyridin-2-yl]piperidine-4-amido}benzoate
SMILES
COC(c(cc1)ccc1NC(C(CC1)CCN1c1nccc(C(N2CCCC2)=O)c1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
436.51
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.849
Distribution Coefficient, logD
2.843
Water Solubility, LogSw
-3.40
Polar Surface Area
73.482
Acid Dissociation Constant (pKa)
10.39
Base Dissociation Constant (pKb)
5.52
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
41.70
G826-0426 in Drug Discovery
Included in Screening Libraries
Macl-GPIb alpha Interaction Library (22969 compounds)
PI3K-Targeted Library (17255 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Cancer
- Endocrine
- Kinases
- PPI modulators
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with G826-0426 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)