S329-4408 Screening compound: N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-(oxan-4-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound S329-4408
N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-(oxan-4-yl)acetamide
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
S329-4408
Molecular Formula
C19H25BrN2O3 (C19 H25 BrN2 O3)
Compound Name
N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-(oxan-4-yl)acetamide
IUPAC name
N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-(oxan-4-yl)acetamide
SMILES
CC(N(C(CC1)CCN1C(c(cc1)ccc1Br)=O)C1CCOCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.32
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.488
Distribution Coefficient, logD
2.488
Water Solubility, LogSw
-2.34
Polar Surface Area
39.879
Acid Dissociation Constant (pKa)
25.79
Base Dissociation Constant (pKb)
6.85
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
57.90
S329-4408 in Drug Discovery
Included in Screening Libraries
Bromodomain Modulators Library (5801 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Soluble Diversity Library (15920 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Anti-HIV1 Library (19540 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
- Cyclic compounds
- Antiviral
- Infections
- Immune system
- Agro
References: we are preparing a list of scientific research reports with S329-4408 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)