P435-0358 Screening compound: 1-CYCLOHEXANECARBONYL-4-[5-METHYL-4-(PIPERIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINE
Chemical Structure Depiction of ChemDiv screening compound P435-0358
1-CYCLOHEXANECARBONYL-4-[5-METHYL-4-(PIPERIDINE-1-CARBONYL)-1,3-OXAZOL-2-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
P435-0358
Molecular Formula
C22H33N3O3 (C22 H33 N3 O3)
Compound Name
1-CYCLOHEXANECARBONYL-4-[5-METHYL-4-(PIPERIDINE-1-CARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINE
IUPAC name
n/a
SMILES
Cc1c(C(N2CCCCC2)=O)nc(C(CC2)CCN2C(C2CCCCC2)=O)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.52
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.425
Distribution Coefficient, logD
3.425
Water Solubility, LogSw
-3.24
Polar Surface Area
51.354
Acid Dissociation Constant (pKa)
23.34
Base Dissociation Constant (pKb)
-0.74
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
77.30
P435-0358 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
References: we are preparing a list of scientific research reports with P435-0358 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)