M284-0521 Screening compound: N~1~-[2-(1-azepanyl)ethyl]-2-[7-fluoro-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
Chemical Structure Depiction of ChemDiv screening compound M284-0521
N~1~-[2-(1-azepanyl)ethyl]-2-[7-fluoro-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
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
M284-0521
Molecular Formula
C22H29FN4O3 (C22 H29 FN4 O3)
Compound Name
N~1~-[2-(1-azepanyl)ethyl]-2-[7-fluoro-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
IUPAC name
N-[2-(azepan-1-yl)ethyl]-2-{13-fluoro-28-dioxo-39-diazatricyclo[8.4.0.0^{37}]tetradeca-1(14)1012-trien-9-yl}acetamide
SMILES
O=C(CN(c(ccc(F)c1)c1C(N1C2CCC1)=O)C2=O)NCCN1CCCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
416.5
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.093
Distribution Coefficient, logD
-0.393
Water Solubility, LogSw
-2.47
Polar Surface Area
60.900
Acid Dissociation Constant (pKa)
13.88
Base Dissociation Constant (pKb)
8.87
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
59.10
M284-0521 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
3D-Pharmacophore Based Diversity Library (49813 compounds)
Anticancer Library (62698 compounds)
Antiviral Library (67538 compounds)
CNS BBB Library (22607 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Nonpeptide Peptidomimetics PPI Library (18997 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Protein-Protein Interaction Library (218420 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Epigenetics Focused Set (26518 compounds)
Ion Channels Focused Library (26372 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Peptidomimetic Library (37031 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- 3D
- Mimetics
- Mimetics
- Cyclic compounds
- Mimetics
- Mimetics
- Cancer
- Antiviral
- Infections
- Immune system
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Nervous system
- Cardiovascular
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Proteases
- Ion Channels
References: we are preparing a list of scientific research reports with M284-0521 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)