8264-0686 Screening compound: N-pentyl-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]benzamide
Chemical Structure Depiction of ChemDiv screening compound 8264-0686
N-pentyl-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]benzamide
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
8264-0686
Molecular Formula
C22H28N2O (C22 H28 N2 O)
Compound Name
N-pentyl-4-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]benzamide
IUPAC name
N-pentyl-4-[(1234-tetrahydroisoquinolin-2-yl)methyl]benzamide
SMILES
CCCCCNC(c1ccc(CN(CC2)Cc3c2cccc3)cc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
336.48
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
4.350
Distribution Coefficient, logD
4.069
Water Solubility, LogSw
-4.06
Polar Surface Area
28.159
Acid Dissociation Constant (pKa)
13.45
Base Dissociation Constant (pKb)
7.36
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.90
8264-0686 in Drug Discovery
Included in Screening Libraries
Protein Arginine Methyltransferases Library (27925 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with 8264-0686 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)