P435-1862 Screening compound: 4-[(4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carbonyl}piperidin-1-yl)sulfonyl]morpholine
Chemical Structure Depiction of ChemDiv screening compound P435-1862
4-[(4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carbonyl}piperidin-1-yl)sulfonyl]morpholine
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
P435-1862
Molecular Formula
C24H37N5O6S (C24 H37 N5 O6 S)
Compound Name
4-[(4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carbonyl}piperidin-1-yl)sulfonyl]morpholine
IUPAC name
4-[(4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-13-oxazol-2-yl]piperidine-1-carbonyl}piperidin-1-yl)sulfonyl]morpholine
SMILES
Cc1c(C(N2CCCC2)=O)nc(C(CC2)CCN2C(C(CC2)CCN2S(N2CCOCC2)(=O)=O)=O)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
523.65
Hydrogen Bond Acceptors Count
13.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
11
Partition Coefficient, logP
0.771
Distribution Coefficient, logD
0.771
Water Solubility, LogSw
-1.38
Polar Surface Area
93.553
Acid Dissociation Constant (pKa)
23.63
Base Dissociation Constant (pKb)
-0.46
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
79.17
P435-1862 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Included in 1.7M Stock Database
- Nervous system
- PPI modulators
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with P435-1862 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)