N051-0069 Screening compound: N-methyl-N-[(7R,8S)-2-oxa-6-azatricyclo[4.2.1.0~3,7~]non-8-yl]amine
Chemical Structure Depiction of ChemDiv screening compound N051-0069
N-methyl-N-[(7R,8S)-2-oxa-6-azatricyclo[4.2.1.0~3,7~]non-8-yl]amine
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
N051-0069
Molecular Formula
C8H14N2O (C8 H14 N2 O)
Compound Name
N-methyl-N-[(7R,8S)-2-oxa-6-azatricyclo[4.2.1.0~3,7~]non-8-yl]amine
IUPAC name
(7R8S)-N-methyl-2-oxa-6-azatricyclo[4.2.1.0^{37}]nonan-8-amine
SMILES
CN[C@H]1[C@H]2N3CC1OC2CC3
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
2HCl
Molecular Weight
154.21
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
0.005
Distribution Coefficient, logD
-0.913
Water Solubility, LogSw
0.18
Polar Surface Area
24.436
Acid Dissociation Constant (pKa)
25.78
Base Dissociation Constant (pKb)
8.26
Number of Chiral Centers
4.00
Percent sp3 carbon bonding
100.00
N051-0069 in Drug Discovery
Included in Screening Libraries
3D-Fragment Library (4274 compounds)
3D Mimetics PPI Library (1617 compounds)
Protein-Protein Interaction Library (218420 compounds)
Epigenetics Focused Set (26518 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- 3D
- Fragments
- Mimetics
- 3D
- Mimetics
- PPI modulators
- PPI modulators
References: we are preparing a list of scientific research reports with N051-0069 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)