S734-1061 Screening compound: N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]pyridine-3-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound S734-1061
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]pyridine-3-sulfonamide
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
S734-1061
Molecular Formula
C21H26N4O4S (C21 H26 N4 O4 S)
Compound Name
N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]pyridine-3-sulfonamide
IUPAC name
N-[2-oxo-2-(4-oxo-2-phenyl-15-diazecan-1-yl)ethyl]pyridine-3-sulfonamide
SMILES
O=C(CNS(c1cnccc1)(=O)=O)N(CCCCCNC(C1)=O)C1c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
430.53
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
0.885
Distribution Coefficient, logD
0.880
Water Solubility, LogSw
-1.88
Polar Surface Area
92.684
Acid Dissociation Constant (pKa)
9.32
Base Dissociation Constant (pKb)
-0.74
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
38.10
S734-1061 in Drug Discovery
Included in Screening Libraries
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
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Cyclic compounds
- Mimetics
- Mimetics
References: we are preparing a list of scientific research reports with S734-1061 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)