E234-0991 Screening compound: 2-[(3-CHLOROPHENYL)METHYL]-N-CYCLOPENTYL-3-METHYL-1-OXO-1H,2H,3H,4H-PYRAZINO[1,2-A]INDOLE-3-CARBOXAMIDE
Chemical Structure Depiction of ChemDiv screening compound E234-0991
2-[(3-CHLOROPHENYL)METHYL]-N-CYCLOPENTYL-3-METHYL-1-OXO-1H,2H,3H,4H-PYRAZINO[1,2-A]INDOLE-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
E234-0991
Molecular Formula
C25H26ClN3O2 (C25 H26 ClN3 O2)
Compound Name
2-[(3-CHLOROPHENYL)METHYL]-N-CYCLOPENTYL-3-METHYL-1-OXO-1H,2H,3H,4H-PYRAZINO[1,2-A]INDOLE-3-CARBOXAMIDE
IUPAC name
n/a
SMILES
CC(Cn(c1c2)c3c2cccc3)(C(NC2CCCC2)=O)N(Cc2cccc(Cl)c2)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
435.95
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.502
Distribution Coefficient, logD
5.502
Water Solubility, LogSw
-5.89
Polar Surface Area
41.103
Acid Dissociation Constant (pKa)
15.20
Base Dissociation Constant (pKb)
3.77
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
36.00
E234-0991 in Drug Discovery
Included in Screening Libraries
Cyclic Ugi PPI Library (9586 compounds)
GPCR Targeted Library (31838 compounds)
Protein-Protein Interaction Library (218420 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Receptor's ligands
- PPI modulators
- Cyclic compounds
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
References: we are preparing a list of scientific research reports with E234-0991 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)