P935-1593 Screening compound: 1-cyclopentanecarbonyl-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidine
Chemical Structure Depiction of ChemDiv screening compound P935-1593
1-cyclopentanecarbonyl-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidine
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
P935-1593
Molecular Formula
C17H26N4O (C17 H26 N4 O)
Compound Name
1-cyclopentanecarbonyl-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidine
IUPAC name
1-cyclopentanecarbonyl-2-[4-(cyclopropylmethyl)-4H-124-triazol-3-yl]piperidine
SMILES
O=C(C1CCCC1)N(CCCC1)C1c1nncn1CC1CC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
302.42
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.287
Distribution Coefficient, logD
2.287
Water Solubility, LogSw
-1.95
Polar Surface Area
41.747
Acid Dissociation Constant (pKa)
21.08
Base Dissociation Constant (pKb)
3.24
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
82.40
P935-1593 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Bcl2-PPI Inhibitors Library (12246 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Soluble Diversity Library (15920 compounds)
Akt-Targeted Library (14764 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Cancer
- Hemic and lymphatic
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- PPI modulators
- PPI modulators
- Kinases
- Cyclic compounds
References: we are preparing a list of scientific research reports with P935-1593 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)