V012-7975 Screening compound: benzyl[3-(benzyloxy)-2-hydroxypropyl][(2-fluorophenyl)methyl]amine
Chemical Structure Depiction of ChemDiv screening compound V012-7975
benzyl[3-(benzyloxy)-2-hydroxypropyl][(2-fluorophenyl)methyl]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
V012-7975
Molecular Formula
C24H26FNO2 (C24 H26 FNO2)
Compound Name
benzyl[3-(benzyloxy)-2-hydroxypropyl][(2-fluorophenyl)methyl]amine
IUPAC name
benzyl[3-(benzyloxy)-2-hydroxypropyl][(2-fluorophenyl)methyl]amine
SMILES
OC(CN(Cc1ccccc1)Cc(cccc1)c1F)COCc1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
379.47
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
4.701
Distribution Coefficient, logD
4.673
Water Solubility, LogSw
-4.59
Polar Surface Area
28.732
Acid Dissociation Constant (pKa)
14.75
Base Dissociation Constant (pKb)
6.23
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
25.00
V012-7975 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
Cardiovascular Library (22201 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cardiovascular
References: we are preparing a list of scientific research reports with V012-7975 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)