E679-0763 Screening compound: 1'-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}-1,4'-bipiperidine
Chemical Structure Depiction of ChemDiv screening compound E679-0763
1'-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}-1,4'-bipiperidine
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
E679-0763
Molecular Formula
C20H30N6 (C20 H30 N6)
Compound Name
1'-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}-1,4'-bipiperidine
IUPAC name
1'-{6H7H8H9H10H-azepino[21-h]purin-4-yl}-14'-bipiperidine
SMILES
C(CC1)CCN1C(CC1)CCN1c1ncnc2c1nc1n2CCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
354.5
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.283
Distribution Coefficient, logD
0.724
Water Solubility, LogSw
-3.24
Polar Surface Area
39.689
Acid Dissociation Constant (pKa)
18.78
Base Dissociation Constant (pKb)
9.96
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
75.00
E679-0763 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Allosteric Kinases Inhibitors Library (23117 compounds)
DGK Inhibitors Library (10558 compounds)
GPCR Targeted Library (31838 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Akt-Targeted Library (14764 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
New Agro Library (44492 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Cancer
- Digestive system
- Hemic and lymphatic
- Skin
- Metabolic
- Immune system
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
- Kinases
- GPCR
- Kinases
- Kinases
- Receptor's ligands
- PPI modulators
- PPI modulators
- Cyclic compounds
- Mimetics
- Agro
References: we are preparing a list of scientific research reports with E679-0763 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)