1711-1336 Screening compound: 17-acetyl-2-oxa-15-azatetracyclo[7.5.3.0~1,10~.0~3,8~]heptadeca-3,5,7-trien-16-one
Chemical Structure Depiction of ChemDiv screening compound 1711-1336
17-acetyl-2-oxa-15-azatetracyclo[7.5.3.0~1,10~.0~3,8~]heptadeca-3,5,7-trien-16-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
1711-1336
Molecular Formula
C17H19NO3 (C17 H19 NO3)
Compound Name
17-acetyl-2-oxa-15-azatetracyclo[7.5.3.0~1,10~.0~3,8~]heptadeca-3,5,7-trien-16-one
IUPAC name
17-acetyl-2-oxa-15-azatetracyclo[7.5.3.0^{110}.0^{38}]heptadeca-357-trien-16-one
SMILES
CC(C(C(C1CCCC2)c(cccc3)c3OC12N1)C1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
285.34
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
2.350
Distribution Coefficient, logD
2.349
Water Solubility, LogSw
-3.21
Polar Surface Area
47.187
Acid Dissociation Constant (pKa)
10.37
Base Dissociation Constant (pKb)
-2.80
Number of Chiral Centers
4.00
Percent sp3 carbon bonding
52.90
1711-1336 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Anti-infective Library (19449 compounds)
Antiviral Library (67538 compounds)
Dark Chemical Matter Library (18430 compounds)
Frequent Hitters Library (7624 compounds)
GPCR Targeted Library (31838 compounds)
Human Proteases Annotated Library (2868 compounds)
Protein-Protein Interaction Library (218420 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Spiro Library (21655 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Pool
- Pool
- Cyclic compounds
- Cyclic compounds
- Infections
- Immune system
- animal
- Antiviral
- Infections
- Immune system
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- GPCR
- Receptor's ligands
- PPI modulators
- PPI modulators
- Epigenetic
References: we are preparing a list of scientific research reports with 1711-1336 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)