M743-0203 Screening compound: 4-(3-{[3-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)benzonitrile
Chemical Structure Depiction of ChemDiv screening compound M743-0203
4-(3-{[3-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)benzonitrile
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
M743-0203
Molecular Formula
C25H27N3O3 (C25 H27 N3 O3)
Compound Name
4-(3-{[3-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)benzonitrile
IUPAC name
4-(3-{[3-(pyrrolidine-1-carbonyl)phenoxy]methyl}piperidine-1-carbonyl)benzonitrile
SMILES
N#Cc(cc1)ccc1C(N1CC(COc2cc(C(N3CCCC3)=O)ccc2)CCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
417.51
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.979
Distribution Coefficient, logD
2.979
Water Solubility, LogSw
-3.31
Polar Surface Area
58.118
Acid Dissociation Constant (pKa)
25.04
Base Dissociation Constant (pKb)
-2.83
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
40.00
M743-0203 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
RAR (Nuclear receptors) Ligands Library (6524 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Receptor's ligands
- Cancer
- Respiratory tract
- Eye
- Male
- Female
- Hemic and lymphatic
- Congenital
- Skin
- Endocrine
- Immune system
- Nuclear receptors
- Cyclic compounds
References: we are preparing a list of scientific research reports with M743-0203 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)