C276-0729 Screening compound: 9-(2-ethoxy-3-methoxyphenyl)-2H,3H,6H,7H,8H,9H-[1,4]dioxino[2,3-g]quinolin-7-one
Chemical Structure Depiction of ChemDiv screening compound C276-0729
9-(2-ethoxy-3-methoxyphenyl)-2H,3H,6H,7H,8H,9H-[1,4]dioxino[2,3-g]quinolin-7-one
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
C276-0729
Molecular Formula
C20H21NO5 (C20 H21 NO5)
Compound Name
9-(2-ethoxy-3-methoxyphenyl)-2H,3H,6H,7H,8H,9H-[1,4]dioxino[2,3-g]quinolin-7-one
IUPAC name
9-(2-ethoxy-3-methoxyphenyl)-2H3H6H7H8H9H-[14]dioxino[23-g]quinolin-7-one
SMILES
CCOc1c(C(C2)c(cc3OCCOc3c3)c3NC2=O)cccc1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
355.39
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.827
Distribution Coefficient, logD
1.827
Water Solubility, LogSw
-2.47
Polar Surface Area
55.538
Acid Dissociation Constant (pKa)
11.12
Base Dissociation Constant (pKb)
-0.57
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
35.00
C276-0729 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Anti-Aging Library (44940 compounds)
Anticancer Library (62698 compounds)
Cardiovascular Library (22201 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
- Musculoskeletal
- Metabolic
- Immune system
- Cancer
- Cardiovascular
- Epigenetic
References: we are preparing a list of scientific research reports with C276-0729 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)