C276-0615 Screening compound: 2-phenoxyethyl 6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of ChemDiv screening compound C276-0615
2-phenoxyethyl 6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
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
C276-0615
Molecular Formula
C26H27NO6 (C26 H27 NO6)
Compound Name
2-phenoxyethyl 6-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
IUPAC name
2-phenoxyethyl 6-(34-dimethoxyphenyl)-3-methyl-4-oxo-4567-tetrahydro-1H-indole-2-carboxylate
SMILES
Cc1c(C(OCCOc2ccccc2)=O)[nH]c(CC(C2)c(cc3)cc(OC)c3OC)c1C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
449.5
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.997
Distribution Coefficient, logD
3.997
Water Solubility, LogSw
-4.28
Polar Surface Area
68.496
Acid Dissociation Constant (pKa)
12.73
Base Dissociation Constant (pKb)
-4.13
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.80
C276-0615 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Antimitotic Tubulin Library (17355 compounds)
Antiviral Annotated Library (21441 compounds)
Antiviral Library (67538 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
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with C276-0615 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)