M378-0763 Screening compound: 2-furyl(1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indol-5-yl)methanone
Chemical Structure Depiction of ChemDiv screening compound M378-0763
2-furyl(1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indol-5-yl)methanone
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
M378-0763
Molecular Formula
C17H16N2O2 (C17 H16 N2 O2)
Compound Name
2-furyl(1-methyl-1,3,4,6-tetrahydro-5H-azepino[5,4,3-cd]indol-5-yl)methanone
IUPAC name
10-(furan-2-carbonyl)-3-methyl-310-diazatricyclo[6.4.1.0^{413}]trideca-1468(13)-tetraene
SMILES
Cn1c2cccc(CN(CC3)C(c4ccco4)=O)c2c3c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
280.33
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
2.377
Distribution Coefficient, logD
2.377
Water Solubility, LogSw
-2.49
Polar Surface Area
28.018
Acid Dissociation Constant (pKa)
26.29
Base Dissociation Constant (pKb)
-0.37
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.50
M378-0763 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Bromodomain Modulators Library (5801 compounds)
Indole Derivatives (10091 compounds)
Nonpeptide Peptidomimetics PPI Library (18997 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Epigenetics Focused Set (26518 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Epigenetic
- PPI modulators
- PPI modulators
- PPI modulators
- Cyclic compounds
- Mimetics
- Cyclic compounds
- Mimetics
References: we are preparing a list of scientific research reports with M378-0763 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)