K786-7172 Screening compound: 1-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]piperidine-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound K786-7172
1-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]piperidine-3-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
K786-7172
Molecular Formula
C23H44N4O3S (C23 H44 N4 O3 S)
Compound Name
1-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]piperidine-3-carboxamide
IUPAC name
1-[(35-dimethylpiperidin-1-yl)sulfonyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]piperidine-3-carboxamide
SMILES
CCC1N(CCCNC(C(CCC2)CN2S(N2CC(C)CC(C)C2)(=O)=O)=O)CCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
456.69
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.606
Distribution Coefficient, logD
-0.319
Water Solubility, LogSw
-2.89
Polar Surface Area
62.205
Acid Dissociation Constant (pKa)
15.27
Base Dissociation Constant (pKb)
10.32
Number of Chiral Centers
4.00
Percent sp3 carbon bonding
95.70
K786-7172 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Proteases
References: we are preparing a list of scientific research reports with K786-7172 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)