E203-1224 Screening compound: methyl 4-[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-amido]benzoate
Chemical Structure Depiction of ChemDiv screening compound E203-1224
methyl 4-[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-amido]benzoate
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
E203-1224
Molecular Formula
C22H21N3O5S (C22 H21 N3 O5 S)
Compound Name
methyl 4-[4-(2,3-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-amido]benzoate
IUPAC name
methyl 4-[4-(23-dihydro-1H-indole-1-sulfonyl)-1-methyl-1H-pyrrole-2-amido]benzoate
SMILES
Cn1c(C(Nc(cc2)ccc2C(OC)=O)=O)cc(S(N(CC2)c3c2cccc3)(=O)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
439.49
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.084
Distribution Coefficient, logD
3.076
Water Solubility, LogSw
-3.70
Polar Surface Area
78.332
Acid Dissociation Constant (pKa)
9.11
Base Dissociation Constant (pKb)
-2.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
18.20
E203-1224 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Protein Arginine Methyltransferases Library (27925 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
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with E203-1224 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)