E848-2925 Screening compound: N-[(2-methoxyphenyl)methyl]-2-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
Chemical Structure Depiction of ChemDiv screening compound E848-2925
N-[(2-methoxyphenyl)methyl]-2-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
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
E848-2925
Molecular Formula
C23H27N3O4S (C23 H27 N3 O4 S)
Compound Name
N-[(2-methoxyphenyl)methyl]-2-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
IUPAC name
N-[(2-methoxyphenyl)methyl]-2-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
SMILES
CC(C(NCc(cccc1)c1OC)=O)n(cc1)c(cc2)c1cc2S(N1CCCC1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
441.55
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.927
Distribution Coefficient, logD
2.927
Water Solubility, LogSw
-3.47
Polar Surface Area
66.881
Acid Dissociation Constant (pKa)
12.52
Base Dissociation Constant (pKb)
-0.74
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
34.80
E848-2925 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Angiogenesis library (14822 compounds)
Human Proteases Annotated Library (2868 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Cancer
References: we are preparing a list of scientific research reports with E848-2925 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)