F817-1750 Screening compound: 1-{[4-(azepane-1-carbonyl)thiophen-2-yl]sulfonyl}-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound F817-1750
1-{[4-(azepane-1-carbonyl)thiophen-2-yl]sulfonyl}-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide
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
F817-1750
Molecular Formula
C23H31N3O5S2 (C23 H31 N3 O5 S2)
Compound Name
1-{[4-(azepane-1-carbonyl)thiophen-2-yl]sulfonyl}-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide
IUPAC name
1-{[4-(azepane-1-carbonyl)thiophen-2-yl]sulfonyl}-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide
SMILES
Cc1ccc(CNC(C(CC2)CCN2S(c2cc(C(N3CCCCCC3)=O)cs2)(=O)=O)=O)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
493.65
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.844
Distribution Coefficient, logD
2.844
Water Solubility, LogSw
-3.34
Polar Surface Area
81.623
Acid Dissociation Constant (pKa)
12.38
Base Dissociation Constant (pKb)
-0.77
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
56.50
F817-1750 in Drug Discovery
Included in Screening Libraries
Macl-GPIb alpha Interaction Library (22969 compounds)
Nonpeptide Peptidomimetics PPI Library (18997 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- Hemic and lymphatic
- Cardiovascular
- PPI modulators
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with F817-1750 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)