D294-4837 Screening compound: 1-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound D294-4837
1-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(3,4-dimethylphenyl)-5-oxopyrrolidine-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
D294-4837
Molecular Formula
C23H24ClN3O2 (C23 H24 ClN3 O2)
Compound Name
1-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
IUPAC name
1-[2-(5-chloro-1H-indol-3-yl)ethyl]-N-(34-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILES
Cc(cc1)c(C)cc1NC(C(C1)CN(CCc2c[nH]c(cc3)c2cc3Cl)C1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.92
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.860
Distribution Coefficient, logD
3.860
Water Solubility, LogSw
-4.25
Polar Surface Area
50.375
Acid Dissociation Constant (pKa)
11.99
Base Dissociation Constant (pKb)
-1.00
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.40
D294-4837 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with D294-4837 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)