S790-0148 Screening compound: 5-{1-[2-(2-OXOPYRROLIDIN-1-YL)ACETYL]PIPERIDINE-4-CARBONYL}-1,5-DIAZACYCLOUNDECAN-2-ONE
Chemical Structure Depiction of ChemDiv screening compound S790-0148
5-{1-[2-(2-OXOPYRROLIDIN-1-YL)ACETYL]PIPERIDINE-4-CARBONYL}-1,5-DIAZACYCLOUNDECAN-2-ONE
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
S790-0148
Molecular Formula
C21H34N4O4 (C21 H34 N4 O4)
Compound Name
5-{1-[2-(2-OXOPYRROLIDIN-1-YL)ACETYL]PIPERIDINE-4-CARBONYL}-1,5-DIAZACYCLOUNDECAN-2-ONE
IUPAC name
n/a
SMILES
O=C(CN(CCC1)C1=O)N(CC1)CCC1C(N(CCCCCCN1)CCC1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
406.53
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
-1.050
Distribution Coefficient, logD
-1.050
Water Solubility, LogSw
-0.52
Polar Surface Area
75.896
Acid Dissociation Constant (pKa)
14.79
Base Dissociation Constant (pKb)
5.91
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
81.00
S790-0148 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Macrocycles Library (2450 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Protein-Protein Interaction Library (218420 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- Mimetics
- Mimetics
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
References: we are preparing a list of scientific research reports with S790-0148 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)