G893-0454 Screening compound: 2-(2-methoxybenzyl)-N~1~-(2-methoxyethyl)-3-oxo-1-isoindolinecarboxamide
Chemical Structure Depiction of ChemDiv screening compound G893-0454
2-(2-methoxybenzyl)-N~1~-(2-methoxyethyl)-3-oxo-1-isoindolinecarboxamide
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
G893-0454
Molecular Formula
C20H22N2O4 (C20 H22 N2 O4)
Compound Name
2-(2-methoxybenzyl)-N~1~-(2-methoxyethyl)-3-oxo-1-isoindolinecarboxamide
IUPAC name
N-(2-methoxyethyl)-2-[(2-methoxyphenyl)methyl]-3-oxo-23-dihydro-1H-isoindole-1-carboxamide
SMILES
COCCNC(C(c1c2cccc1)N(Cc(cccc1)c1OC)C2=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
354.41
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.227
Distribution Coefficient, logD
2.227
Water Solubility, LogSw
-2.89
Polar Surface Area
56.788
Acid Dissociation Constant (pKa)
13.91
Base Dissociation Constant (pKb)
-0.67
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.00
G893-0454 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
Anticancer Library (62698 compounds)
Cyclic Ugi PPI Library (9586 compounds)
Voltage-Gated Ion Channel-Targeted Library (4740 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Nervous system
- Cancer
- PPI modulators
- PPI modulators
- Cyclic compounds
- Ion Channels
References: we are preparing a list of scientific research reports with G893-0454 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)