T654-0005 Screening compound: 1-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-indol-1-yl]-2-(2-methoxyethoxy)-1-ethanone
Chemical Structure Depiction of ChemDiv screening compound T654-0005
1-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-indol-1-yl]-2-(2-methoxyethoxy)-1-ethanone
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
T654-0005
Molecular Formula
C18H23N3O4 (C18 H23 N3 O4)
Compound Name
1-[2-(5-isopropyl-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-indol-1-yl]-2-(2-methoxyethoxy)-1-ethanone
IUPAC name
2-(2-methoxyethoxy)-1-{2-[5-(propan-2-yl)-124-oxadiazol-3-yl]-23-dihydro-1H-indol-1-yl}ethan-1-one
SMILES
CC(C)c1nc(C(C2)N(C(COCCOC)=O)c3c2cccc3)no1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
345.4
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.148
Distribution Coefficient, logD
2.148
Water Solubility, LogSw
-2.45
Polar Surface Area
63.382
Acid Dissociation Constant (pKa)
20.27
Base Dissociation Constant (pKb)
-3.17
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
50.00
T654-0005 in Drug Discovery
Included in Screening Libraries
Indole Derivatives (10091 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Inhibitors of beta-Catenin Signaling (7445 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
MEF2-HDAC (class II) Modulators Library (5147 compounds)
SH2 PTB Focused Library (6188 compounds)
Included in 1.7M Stock Database
- Cyclic compounds
- Cyclic compounds
- PPI modulators
- PPI modulators
- PPI modulators
- Epigenetic
- Cancer
- Cancer
- Musculoskeletal
- Female
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with T654-0005 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)