3702-0500 Screening compound: 1-[(2-chlorophenyl)methyl]-4-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]piperazine
Chemical Structure Depiction of ChemDiv screening compound 3702-0500
1-[(2-chlorophenyl)methyl]-4-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]piperazine
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
3702-0500
Molecular Formula
C20H23ClN2O3 (C20 H23 ClN2 O3)
Compound Name
1-[(2-chlorophenyl)methyl]-4-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]piperazine
IUPAC name
1-[(2-chlorophenyl)methyl]-4-[(7-methoxy-2H-13-benzodioxol-5-yl)methyl]piperazine
SMILES
COc1c2OCOc2cc(CN2CCN(Cc(cccc3)c3Cl)CC2)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
HOOCCOOH
Molecular Weight
374.87
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.391
Distribution Coefficient, logD
1.020
Water Solubility, LogSw
-3.62
Polar Surface Area
31.942
Acid Dissociation Constant (pKa)
28.48
Base Dissociation Constant (pKb)
9.77
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.00
3702-0500 in Drug Discovery
Included in Screening Libraries
Anti-infective Library (19449 compounds)
Antimitotic Tubulin Library (17355 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Nervous system
References: we are preparing a list of scientific research reports with 3702-0500 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)